2-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-5-(hydroxymethyl)-1H-imidazol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-5-(hydroxymethyl)-1H-imidazol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
2-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-5-(hydroxymethyl)-1H-imidazol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F711-0639 |
| Compound Name: | 2-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-5-(hydroxymethyl)-1H-imidazol-1-yl]-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 472.99 |
| Molecular Formula: | C23 H25 Cl N4 O3 S |
| Smiles: | Cc1ccc(CNC(Cn2c(CO)cnc2SCC(Nc2ccc(C)c(c2)[Cl])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0106 |
| logD: | 4.0102 |
| logSw: | -4.1426 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.98 |
| InChI Key: | WWBGTYDZSBRIOR-UHFFFAOYSA-N |