Basic information
- CAS
40828-44-2- Standard SMILES
CN1C(=N)N(c2ccc(Cl)cc2)CC1=O- InChIKey
TUQAUZURSHKTFF-UHFFFAOYSA-N- Molecular formula
- C10H10ClN3O
- Average molar mass
- 223.66 g/mol
- Monoisotopic mass
- 223.0512396
Overview
Clazolimine is a member of imidazolidines.
Names & identifiers
- Preferred name
- Clazolimine
- IUPAC
- 1-(4-chlorophenyl)-2-imino-3-methylimidazolidin-4-one
- English name
- Clazolimine
- Molecular formula
- C10H10ClN3O
- Molecular weight
- 223.66
Names & synonyms
CLAZOLIMINE40828-44-2Clazolimina1-(4-chlorophenyl)-2-imino-3-methylimidazolidin-4-oneCL-88893CL 88,893C3XSG3DLPAClazoliminumUNII-C3XSG3DLPAClazolimine [USAN:INN]Clazoliminum [INN-Latin]Clazolimina [INN-Spanish]
Show more names
1-(4-Chlorophenyl)-2-imino-3-methyl-2,3,4,5-tetrahydro-1H-imidazol-4-one
CL 88893CLAZOLIMINE [INN]Clazolimine (USAN/INN)CLAZOLIMINE [USAN]SCHEMBL6356331-(p-Chlorophenyl)-2-imino-3-methyl-4-imidazolidinoneCHEMBL21041564-Imidazolidinone, 1-(4-chlorophenyl)-2-imino-3-methyl-
Database identifiers
- CAS
40828-44-2- PubChem CID
- 38683
- DTXSID
DTXSID50866017- ChEMBL
CHEMBL2104156- ChEBI
CHEBI:177628- UNII
- C3XSG3DLPA
- Nikkaji
- J16.606E
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 47.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 312.3 · 312.3±44.0 °C(Predicted)
- Density
- 1.39 · 1.39±0.1 g/cm3(Predicted)
- pka
- 2.01 · 2.01±0.30(Predicted)
- FDA UNII
- 3 XSG3DLPA · C3XSG3DLPA
Chemistry & industry
Applications
UsesDiuretic.
Suppliers2 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
Shanghai New Union Textra Import & Export Co., Ltd.[email protected]
Additional notes
DefinitionChEBI: Clazolimine is a member of imidazolidines.
Related reactions
3 records
Compound notes
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