3-[4-(3-chloro-4-fluorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one
Chemical Structure Depiction of
3-[4-(3-chloro-4-fluorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one
3-[4-(3-chloro-4-fluorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one
Compound characteristics
| Compound ID: | 8017-1282 |
| Compound Name: | 3-[4-(3-chloro-4-fluorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one |
| Molecular Weight: | 415.87 |
| Molecular Formula: | C19 H15 Cl F N5 O S |
| Smiles: | CCN1C=C(C(c2ccc(C)nc12)=O)c1nnc(n1c1ccc(c(c1)[Cl])F)S |
| Stereo: | ACHIRAL |
| logP: | 3.9585 |
| logD: | 3.5908 |
| logSw: | -4.3299 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.483 |
| InChI Key: | VCDKANXBLGVZJD-UHFFFAOYSA-N |