N-(5-chloro-2-methoxyphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G731-0088 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 374.85 |
| Molecular Formula: | C17 H15 Cl N4 O2 S |
| Smiles: | COc1ccc(cc1NC(CSc1nnc(c2ccccc2)[nH]1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.0086 |
| logD: | 1.8168 |
| logSw: | -3.6015 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.556 |
| InChI Key: | RRIDLNXYLFXCPN-UHFFFAOYSA-N |