6-chloro-3-{[4-ethyl-5-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-3-{[4-ethyl-5-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
6-chloro-3-{[4-ethyl-5-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 5236-0309 |
| Compound Name: | 6-chloro-3-{[4-ethyl-5-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 438.98 |
| Molecular Formula: | C23 H23 Cl N4 O S |
| Smiles: | CCn1c(CC(C)C)nnc1SC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6245 |
| logD: | 5.6245 |
| logSw: | -5.843 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.819 |
| InChI Key: | DPPVKZDTSMTKKD-UHFFFAOYSA-N |