1-(ethanesulfonyl)-3-(furan-2-yl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
1-(ethanesulfonyl)-3-(furan-2-yl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine
1-(ethanesulfonyl)-3-(furan-2-yl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0506 |
| Compound Name: | 1-(ethanesulfonyl)-3-(furan-2-yl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C18 H22 N4 O3 S |
| Smiles: | CCS(n1c(NCc2ccc(cc2)C(C)C)nc(c2ccco2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3587 |
| logD: | 3.3587 |
| logSw: | -3.6263 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.978 |
| InChI Key: | OWTRRNKBRCJETP-UHFFFAOYSA-N |