N-cyclohexyl-2-{[3-(phenoxymethyl)-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-1-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-cyclohexyl-2-{[3-(phenoxymethyl)-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-1-yl]sulfanyl}acetamide
N-cyclohexyl-2-{[3-(phenoxymethyl)-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-1-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8008-5039 |
| Compound Name: | N-cyclohexyl-2-{[3-(phenoxymethyl)-4-phenyl-4,5-dihydro-1H-1,2,4-triazol-1-yl]sulfanyl}acetamide |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | C1CCC(CC1)NC(CSN1CN(C(COc2ccccc2)=N1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.785 |
| logD: | 4.7815 |
| logSw: | -4.6399 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.186 |
| InChI Key: | PEJNZIXMPXEGCS-UHFFFAOYSA-N |