2-{3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl}-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one hydrochloride (1:1) | CAS No. 57775-22-1

Basic Information

CAS Number

57775-22-1

Molecular Formula

C19H29Cl2N5O

Molecular Weight

414.38 g/mol

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Basic Physical Properties

Melting Point

197-198 ºC

Boiling Point

499°Cat760mmHg

Density

1.23

Flash Point

255.6°C

SMILES

CCC1=NN(C(=O)N1CC)CCCN2CCN(CC2)C3=CC(=CC=C3)Cl.Cl

InChI

InChI=1S/C19H28ClN5O.ClH/c1-3-18-21-25(19(26)24(18)4-2)10-6-9-22-11-13-23(14-12-22)17-8-5-7-16(20)15-17;/h5,7-8,15H,3-4,6,9-14H2,1-2H3;1H

InChIKey

BHKPQZVLIZKSAG-UHFFFAOYSA-N

LogP

2.914600000000001

Topological Polar Surface Area

46.300000000000004 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

506

Classification & Uses

Chemical Classification

Pharmaceutical Products APIs & Intermediates Intermediates

Safety Information

Toxicity

LD50 in mice, rats (mg/kg): 580, 720 orally; 72, 62 i.v.; 135, 120 i.p. (Lisciani)

Synonyms & References

English

Axiomin
2FSU2FR80J
AKOS027379629
Tropene
McN-A-2673-11
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4,5-diethyl-1,2,4-triazol-3-one;hydrochloride
ETOPERIDONE HYDROCHLORIDE [MART.]
Q27254691
DTXSID30967410
EINECS 258-268-1
Etoperidone hydrochloride [USAN]
2-[3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl]-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one Hydrochloride
Etoran
Etoperidone HCl
ETOPERIDONE HYDROCHLORIDE [WHO-DD]
NSC304398
AF 1191
57775-22-1
SCHEMBL121838
3H-1,2,4-Triazol-3-one, 2-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-4,5-diethyl-2,4-dihydro-, monohydrochloride
1-(3-(4-(M-CHLOROPHENYL)-1-PIPERAZINYL)PROPYL)-3,4-DIETHYL-D2-1,2,4-TRIAZOLIN-5-ONE MONOHYDROCHLORIDE
NSC-304398
ST 1191 HCl
UNII-2FSU2FR80J
ST-1191
Etonin
EINECS 260-942-5
3H-1,4-Triazol-3-one, 2-[3-[4-(3-chlorophenyl)- 1-piperazinyl]propyl]-4,5-diethyl-2,4-dihydro-, monohydrochloride
2-(3-(4-(3-Chlorophenyl)piperazin-1-yl)propyl)-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one monohydrochloride
52942-37-7
AF-1191
Clopradone
2-{3-[4-(3-Chlorophenyl)piperazin-1-yl]propyl}-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one--hydrogen chloride (1/1)
Etonin (TN)
2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one monohydrochloride
D04105
NSC 304398
McN-A 2673-11
1-(3-(4-(3-Chlorophenyl)piperazin-1-yl)propyl)-3,4-diethyl-1H-1,2,4-triazol-5(4H)-one hydrochloride
2-(3-(4-(3-Chlorophenyl)piperazin-1-yl)propyl)-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one hydrochloride
1-(3-(4-(m-Chlorophenyl)-1-piperazinyl)propyl)-3,4-diethyl-delta(sup 2)-1,2,4-triazolin-5-one monohydrochloride
Etoperidone hydrochloride
FT-0668435
Depracer
Etoperidone (hydrochloride)
CHEMBL3085482
ETOPERIDONE HYDROCHLORIDE [MI]
Staff
Clopradone, trazolinone
Etoperidone hydrochloride (USAN)
3H-1,2,4-Triazol-3-one,2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-4,5-diethyl-2,4-dihydro-,hydrochloride (1:1)
Etoperidone Hydrochloride
3H-1,2,4-Triazol-3-one,2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-4,5-diethyl-2,4-dihydro-...
Deprecer
MCN-A-2673-11
ST 1191
2-[3-[4-(3-Chlorophenyl)-1-piperazinyl]propyl]-4,5-diethyl-2,4-dihydro-3H-1,2,4-triazol-3-one monohydrochloride

MDL_Number

MFCD01678245

CAS Number

57775-22-1

Supplier Information

Supplier Name	Member Level	Authentication Status	Main Category	MOQ	Action
China - Shanghai Hansi Chemical Co., Ltd.
China - Shanghai Jixiang Biotechnology Co., Ltd.
China - Shanghai Aladdin Bio-Technologies Co., Ltd.
United States - Khemia Software
Netherlands - Quaron
Germany - Lödige Fördertechnik GmbH
China - GFS Chemicals, Inc.
China - Hebei Honoonyoung Chemical Co., Ltd.