[2-(3-chlorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][2-(methylsulfanyl)pyridin-3-yl]methanone
Chemical Structure Depiction of
[2-(3-chlorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][2-(methylsulfanyl)pyridin-3-yl]methanone
[2-(3-chlorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][2-(methylsulfanyl)pyridin-3-yl]methanone
Compound characteristics
| Compound ID: | P218-0880 |
| Compound Name: | [2-(3-chlorophenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][2-(methylsulfanyl)pyridin-3-yl]methanone |
| Molecular Weight: | 398.91 |
| Molecular Formula: | C20 H19 Cl N4 O S |
| Smiles: | CSc1c(cccn1)C(N1CCCn2c(C1)cc(c1cccc(c1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.532 |
| logD: | 3.5319 |
| logSw: | -3.8984 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.596 |
| InChI Key: | ZEQKNYJGJMIEGZ-UHFFFAOYSA-N |