2-{[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)acetamide
2-{[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | C592-2588 |
| Compound Name: | 2-{[5-(1H-indol-3-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C23 H20 N6 O2 S2 |
| Smiles: | Cc1csc(NC(CSc2nnc(c3c[nH]c4ccccc34)n2c2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4594 |
| logD: | 4.4544 |
| logSw: | -4.297 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.129 |
| InChI Key: | NSAHLPJILJMGFG-UHFFFAOYSA-N |