Basic information
- Standard SMILES
CCCCCCCC(=O)NC(=O)OCc1nc(C(C)C)c(Sc2cc(Cl)cc(Cl)c2)n1Cc1ccncc1- InChIKey
YZUWRYUYJAPZDV-UHFFFAOYSA-N- Molecular formula
- C28H34Cl2N4O3S
- Average molar mass
- 577.6 g/mol
- Monoisotopic mass
- 576.1728675
Names & identifiers
- Preferred name
- [5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]methyl N-octanoylcarbamate
- IUPAC
- [5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]methyl N-octanoylcarbamate
Names & synonyms
SCHEMBL6162355YZUWRYUYJAPZDV-UHFFFAOYSA-N[5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]methyl N-octanoylcarbamate5-(3,5-Dichlorophenylthio)-4-isopropyl-1-(4-pyridylmethyl)-1H-imidazol-2-ylmethyl octanoylcarbamate5-(3,5-Dichlorophenylthio)-4-isopropyl-1-(4-pyridylmethyl)-1H-imidazol-2-ylmethyl-octanoylcarbamate
Database identifiers
- PubChem CID
- 478193
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 14
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 718
Related reactions
1 records
Compound notes
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