6-chloro-3-[(5-cyclopropyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-chloro-3-[(5-cyclopropyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-phenylquinolin-2(1H)-one
6-chloro-3-[(5-cyclopropyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | Y010-1600 |
| Compound Name: | 6-chloro-3-[(5-cyclopropyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 422.93 |
| Molecular Formula: | C22 H19 Cl N4 O S |
| Smiles: | CCn1c(C2CC2)nnc1SC1=C(c2ccccc2)c2cc(ccc2NC1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1898 |
| logD: | 5.1898 |
| logSw: | -5.4688 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.095 |
| InChI Key: | UJXYHYFTWVCRSF-UHFFFAOYSA-N |