7-(3,4-dichlorophenyl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Chemical Structure Depiction of
7-(3,4-dichlorophenyl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
7-(3,4-dichlorophenyl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-3165 |
| Compound Name: | 7-(3,4-dichlorophenyl)-2-(ethylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one |
| Molecular Weight: | 392.26 |
| Molecular Formula: | C16 H11 Cl2 N5 O S |
| Smiles: | CCSc1nc2N=CC3=C(C=CN(C3=O)c3ccc(c(c3)[Cl])[Cl])n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.846 |
| logD: | 3.846 |
| logSw: | -4.1074 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.085 |
| InChI Key: | JCJJDFUNFQRXOK-UHFFFAOYSA-N |