N-[2-({3-bromo-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[2-({3-bromo-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]cyclohexanecarboxamide
N-[2-({3-bromo-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | L150-0320 |
| Compound Name: | N-[2-({3-bromo-1-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]cyclohexanecarboxamide |
| Molecular Weight: | 485.44 |
| Molecular Formula: | C23 H25 Br N4 O S |
| Smiles: | Cc1ccc(Cn2c(nc(n2)[Br])Sc2ccccc2NC(C2CCCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8094 |
| logD: | 5.8094 |
| logSw: | -5.3244 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.62 |
| InChI Key: | URMSFVDXYWQFCF-UHFFFAOYSA-N |