[3-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Chemical Structure Depiction of
[3-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
[3-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | V027-9493 |
| Compound Name: | [3-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone |
| Molecular Weight: | 484.62 |
| Molecular Formula: | C28 H28 N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(Cc2ccccc2)nnc1SCc1cccc(c1)C(N1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1739 |
| logD: | 4.1739 |
| logSw: | -4.2916 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.245 |
| InChI Key: | QXDNXRASIOISGQ-UHFFFAOYSA-N |