Basic information
- CAS
178978-97-7- Standard SMILES
CC(C)c1nc(CO)n(C)c1Sc1cc(Cl)cc(Cl)c1- InChIKey
DPFYGZSOTRICJF-UHFFFAOYSA-N- Molecular formula
- C14H16Cl2N2OS
- Average molar mass
- 331.3 g/mol
- Monoisotopic mass
- 330.03603949
Names & identifiers
- Preferred name
- (5-(3,5-Dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazol-2-yl)methanol
- IUPAC
- [5-(3,5-dichlorophenyl)sulfanyl-1-methyl-4-propan-2-ylimidazol-2-yl]methanol
- English name
- Aids081518
- Molecular formula
- C14H16Cl2N2OS
- Molecular weight
- 331.26
Names & synonyms
178978-97-7(5-((3,5-Dichlorophenyl)thio)-4-isopropyl-1-methyl-1H-imidazol-2-yl)methanol(5-(3,5-Dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazol-2-yl)methanol[5-(3,5-Dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazol-2-yl]methanolCHEMBL577826SCHEMBL6163272SCHEMBL6962129DTXSID30939137DPFYGZSOTRICJF-UHFFFAOYSA-N[5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-1-methyl-imidazol-2-yl]methanol[5-(3,5-dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazol-2-yl]-methanol{5-[(3,5-Dichlorophenyl)sulfanyl]-1-methyl-4-(propan-2-yl)-1H-imidazol-2-yl}methanol
Show more names
Aids081518Aids-0815181H-Imidazole-2-methanol, 5-[(3,5-dichlorophenyl)thio]-1-methyl-4-(1-methylethyl)-
5-(3,5-dichlorophenylthio)-4-isopropyl-1-methyl-2-hydroxymethyl-1H-imidazole
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 312
Related reactions
25 records
Compound notes
Loading…