N-cyclopropyl-4-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzamide
Chemical Structure Depiction of
N-cyclopropyl-4-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzamide
N-cyclopropyl-4-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzamide
Compound characteristics
| Compound ID: | V028-5872 |
| Compound Name: | N-cyclopropyl-4-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzamide |
| Molecular Weight: | 316.42 |
| Molecular Formula: | C16 H20 N4 O S |
| Salt: | not_available |
| Smiles: | CCn1c(C)nnc1SCc1ccc(cc1)C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5602 |
| logD: | 1.56 |
| logSw: | -2.3553 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.484 |
| InChI Key: | UMPLYRQZKPAYCH-UHFFFAOYSA-N |