N-(3-acetylphenyl)-2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(3-acetylphenyl)-2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 8016-9506 |
| Compound Name: | N-(3-acetylphenyl)-2-({4-methyl-5-[(morpholin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C18 H23 N5 O3 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1nnc(CN2CCOCC2)n1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3886 |
| logD: | 0.3875 |
| logSw: | -2.3393 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.916 |
| InChI Key: | ZQSAKPWWNISTJE-UHFFFAOYSA-N |