2-[(5-{[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropylacetamide
Chemical Structure Depiction of
2-[(5-{[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropylacetamide
2-[(5-{[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropylacetamide
Compound characteristics
| Compound ID: | 8018-3769 |
| Compound Name: | 2-[(5-{[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropylacetamide |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C22 H23 N7 O2 S |
| Smiles: | Cc1ccc(c(c1)n1nc2ccccc2n1)OCc1nnc(n1C)SCC(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9212 |
| logD: | 2.9212 |
| logSw: | -3.352 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.874 |
| InChI Key: | IUYPFCPBWQELJL-UHFFFAOYSA-N |