1-[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)ethan-1-one
Chemical Structure Depiction of
1-[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)ethan-1-one
1-[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | P221-0018 |
| Compound Name: | 1-[2-(pyridin-4-yl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C18 H18 N4 O S |
| Smiles: | C1CN(Cc2cc(c3ccncc3)nn2C1)C(Cc1ccsc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1171 |
| logD: | 2.1162 |
| logSw: | -2.5279 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.336 |
| InChI Key: | NQLNJKLWULMMMB-UHFFFAOYSA-N |