N-(2-methoxyethyl)-4-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-4-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-(2-methoxyethyl)-4-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V010-4371 |
| Compound Name: | N-(2-methoxyethyl)-4-({[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C27 H28 N4 O4 S |
| Salt: | not_available |
| Smiles: | COCCNC(c1ccc(CSc2nnc(c3cccc(c3)OC)n2c2ccc(cc2)OC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1446 |
| logD: | 4.1446 |
| logSw: | -4.325 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.669 |
| InChI Key: | MKNVQPOZQVPCTF-UHFFFAOYSA-N |