N-(3-butoxyphenyl)-3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide
Chemical Structure Depiction of
N-(3-butoxyphenyl)-3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide
N-(3-butoxyphenyl)-3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | 8011-6399 |
| Compound Name: | N-(3-butoxyphenyl)-3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanamide |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C16 H22 N4 O2 S |
| Smiles: | CCCCOc1cccc(c1)NC(CCSc1nncn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8126 |
| logD: | 2.8126 |
| logSw: | -3.3865 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.299 |
| InChI Key: | OBQBZMLGPVNALJ-UHFFFAOYSA-N |