N-cyclopropyl-2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-cyclopropyl-2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-cyclopropyl-2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V029-7993 |
| Compound Name: | N-cyclopropyl-2-({[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C20 H20 N4 O S2 |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2cccs2)nnc1SCc1ccccc1C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3458 |
| logD: | 4.3457 |
| logSw: | -4.4731 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.707 |
| InChI Key: | YFMHJCQJCPQAPU-UHFFFAOYSA-N |