(3S)-2-{N-[(1S)-1-Carboxy-3-phenylpropyl]-L-alanyl}-6,7-dimethoxy-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid | CAS No. 103775-14-0

Basic Information

CAS Number

103775-14-0

Molecular Formula

C25H30N2O7

Molecular Weight

470.52 g/mol

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Basic Physical Properties

Melting Point

145-1700C

Boiling Point

717.4°Cat760mmHg

Flash Point

387.7°C

Refractive Index

1.588

SMILES

CC(C(=O)N1CC2=CC(=C(C=C2CC1C(=O)O)OC)OC)NC(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H30N2O7/c1-15(26-19(24(29)30)10-9-16-7-5-4-6-8-16)23(28)27-14-18-13-22(34-3)21(33-2)12-17(18)11-20(27)25(31)32/h4-8,12-13,15,19-20,26H,9-11,14H2,1-3H3,(H,29,30)(H,31,32)/t15-,19-,20-/m0/s1

InChIKey

CMPAGYDKASJORH-YSSFQJQWSA-N

LogP

2.1058000000000003

Topological Polar Surface Area

125.39999999999999 Å²

Hydrogen Bond Donor/Acceptor

3 / 9

Complexity

711

Classification & Uses

Chemical Classification

Pharmaceutical Products APIs & Intermediates Intermediates

Safety Information

Synonyms & References

English

103775-14-0
CHEMBL1201405
Moexiprilat [INN]
3-ISOQUINOLINECARBOXYLIC ACID, 2-((2S)-2-(((1S)-1-CARBOXY-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, (3S)-
(3S)-2-((2S)-2-(((1S)-1-(CARBOXY)-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-3-ISOQUINOLINECARBOXYLIC ACID
UNII-H3753190JS
2-[2-(1-Carboxy-3-phenyl-propylamino)propionyl]-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic Acid
DB14210
(3S)-2-((2S)-N-((1S)-1-Carboxy-3-phenylpropyl)alanyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid
J-001037
RS 10029
RS-10029
Q27087539
(3S)-2-[(2S)-2-[[(2S)-1-hydroxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
GTPL6572
Moexiprilat [INN:BAN]
CAS-103775-14-0
2-(2-(1-carboxy-3-phenylpropyl)amino-1-oxopropyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
moexiprilate
Tox21_113957
Moexiprilat
NCGC00262966-01
MOEXIPRILAT [WHO-DD]
Moexiprilat Hydrate
SCHEMBL616776
3-ISOQUINOLINECARBOXYLIC ACID, 2-(2-((1-(CARBOXY)-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, (3S-(2(R*(R*)),3R*))-
NS00120740
moexiprilatum
DTXSID6057611
H3753190JS
DTXCID7031400
(3S)-2-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
MOEXIPRILAT HYDRATE
2-[2-(1-Carboxy-3-phenyl-propylamino)-propionyl]-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic Acid Hydrate
(3S)-2-[(2S)-2-[[(1S)-1-Carboxy-3-phenylpropyl]aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-diMethoxy-3-isoquinolinecarboxylic Acid
[3S-[2[R*(R*)],3R*]]-2-[2-[(1- Carboxy-3-phenylpropyl)aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-diMethoxy-3-isoquinolinecarboxylic Acid
(3S)-2-[(2S)-2-[[(1S)-1-Carboxy-3-(phenyl-d5)propyl]aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-diMethoxy-3-isoquinolinecarboxylic Acid
[3S-[2[R*(R*)],3R*]]-2-[2-[(1- Carboxy-3-(phenyl-d5)propyl)aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-diMethoxy-3-isoquinolinecarboxylic Acid
Moexipril Related CoMpound A
3-Isoquinolinecarboxylicacid,2-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-,
3-Isoquinolinecarboxylicacid,2-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]-1-oxopropyl]-1,2...
(3S)-2-{(2S)-N-[(1S)-1-Carboxy-3-phenylpropyl]alanyl}-1,2,3,4-tetrahydro-6,7-dimethoxy-3-isoquinolinecarboxylic acid
[3S-[2[R*(R*)],3R*]]-2-[2-[(1- Carboxy-3-phenylpropyl)aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-diMethoxy-3-isoquinolinecarboxylic Acid
[3S-[2[R*(R*)],3R*]]-2-[2-[(1- Carboxy-3-(phenyl-d5)propyl)aMino]-1-oxopropyl]-1,2,3,4-tetrahydro-6,7-diMethoxy-3-isoquinolinecarboxylic Acid
(S)-2-(((S)-1-carboxy-3-phenylpropyl)-L-alanyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

MDL_Number

MFCD08063675

CAS Number

103775-14-0

Supplier Information

Supplier Name	Member Level	Authentication Status	Main Category	MOQ	Action
China - Hubei Qingbei Yunchen Medicine Technology Co., Ltd.
China - Hubei Yangxin Pharmaceutical Technology Co., Ltd.
China - Shanghai SameSharp Biotechnology Co., Ltd.
China - Shanghai Hansi Chemical Co., Ltd.
China - Shanghai Jixiang Biotechnology Co., Ltd.
China - Shanghai Yuansi Biotechnology Co., Ltd.
China - Shanghai Aladdin Bio-Technologies Co., Ltd.
Germany - Umicore AG & Co KG