N-cyclopropyl-2-({[5-(methoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-cyclopropyl-2-({[5-(methoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-cyclopropyl-2-({[5-(methoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V004-8590 |
| Compound Name: | N-cyclopropyl-2-({[5-(methoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C18 H22 N4 O2 S |
| Salt: | not_available |
| Smiles: | COCc1nnc(n1CC=C)SCc1ccccc1C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.397 |
| logD: | 2.3969 |
| logSw: | -2.8709 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.36 |
| InChI Key: | MAJDAZJQHPHMAA-UHFFFAOYSA-N |