N-[(4-methoxyphenyl)methyl]-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-[(4-methoxyphenyl)methyl]-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0771 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-[(1-phenyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 455.54 |
| Molecular Formula: | C25 H21 N5 O2 S |
| Smiles: | COc1ccc(CNC(CSc2c3nnc(c4ccccc4)n3c3ccccc3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4196 |
| logD: | 4.4196 |
| logSw: | -4.293 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.524 |
| InChI Key: | MHDTUDZPRJPWGK-UHFFFAOYSA-N |