2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K822-0303 |
| Compound Name: | 2-({4-benzyl-5-[(1H-indol-3-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C27 H25 N5 O2 S |
| Smiles: | COc1ccc(cc1)NC(CSc1nnc(Cc2c[nH]c3ccccc23)n1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8016 |
| logD: | 4.8016 |
| logSw: | -4.7867 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.509 |
| InChI Key: | UFDBLXXUJRNXSE-UHFFFAOYSA-N |