Basic information
- CAS
4755-59-3- Standard SMILES
CN(C)CCCn1c(=O)n(-c2ccccc2)c2cc(Cl)ccc21- InChIKey
VWXGRWMELBPMCU-UHFFFAOYSA-N- Molecular formula
- C18H20ClN3O
- Average molar mass
- 329.8 g/mol
- Monoisotopic mass
- 329.12949
Overview
Clodazon is a small molecule drug. Clodazon has a monoisotopic molecular weight of 329.13 Da.
Names & identifiers
- Preferred name
- Clodazon
- IUPAC
- 5-chloro-1-[3-(dimethylamino)propyl]-3-phenylbenzimidazol-2-one
- English name
- Clodazon
- Molecular formula
- C18H20ClN3O
- Molecular weight
- 329.82
Names & synonyms
CLODAZONClodazone4755-59-3Clodazon [INN]ClodazonaClodazonumClodazone [INN-French]Clodazonum [INN-Latin]Clodazona [INN-Spanish]UNII-X82H6JOC4HX82H6JOC4HBRN 0894387
Show more names
AW 14/24465-chloro-1-[3-(dimethylamino)propyl]-3-phenylbenzimidazol-2-one5-chloro-1-[3-(dimethylamino)propyl]-3-phenyl-benzimidazol-2-one5-Chloro-1-[3-(dimethylamino)propyl]-3-phenyl-2H-benzimidazol-2-one5-Chloro-1-[3-(dimethylamino)propyl]-3-phenyl-1H-benzimidazol-2(3H)-one2H-Benzimidazol-2-one, 5-chloro-1-[3-(dimethylamino)propyl]-1,3-dihydro-3-phenyl-
AW-142446 FREE BASE5-Chloro-1-(3-(dimethylamino)propyl)-3-phenyl-2-benzimidazolinoneDTXSID301971945-24-02-00399 (Beilstein Handbook Reference)Clodazone (INN-French)Clodazonum (INN-Latin)Clodazona (INN-Spanish)2-Benzimidazolinone, 5-chloro-1-(3-(dimethylamino)propyl)-3-phenyl-
Database identifiers
- CAS
4755-59-3
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 26.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 411
Physicochemical properties
- Boiling point
- 201.5 °C · 201.5°C (rough estimate)
- Density
- 1.2068 · 1.2068 (rough estimate)
- refractive index
- 1.58 · 1.5800 (estimate)
- pka
- 9.55 · 9.55±0.28(Predicted)
- FDA UNII
- 82 H6JOC4H · X82H6JOC4H
Chemistry & industry
Applications
UsesAntidepressant.
Suppliers1 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…