N-(2,4-dimethylphenyl)-2-({5-[(1H-indol-3-yl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-({5-[(1H-indol-3-yl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(2,4-dimethylphenyl)-2-({5-[(1H-indol-3-yl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K822-0289 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-({5-[(1H-indol-3-yl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 431.56 |
| Molecular Formula: | C24 H25 N5 O S |
| Smiles: | Cc1ccc(c(C)c1)NC(CSc1nnc(Cc2c[nH]c3ccccc23)n1CC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3495 |
| logD: | 4.3495 |
| logSw: | -4.2769 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.518 |
| InChI Key: | MRKZZXOKXWTRDG-UHFFFAOYSA-N |