2-[1-(4-fluoro-3-methylbenzene-1-sulfonyl)piperidin-3-yl]-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Chemical Structure Depiction of
2-[1-(4-fluoro-3-methylbenzene-1-sulfonyl)piperidin-3-yl]-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
2-[1-(4-fluoro-3-methylbenzene-1-sulfonyl)piperidin-3-yl]-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Compound characteristics
| Compound ID: | P223-0961 |
| Compound Name: | 2-[1-(4-fluoro-3-methylbenzene-1-sulfonyl)piperidin-3-yl]-5-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one |
| Molecular Weight: | 420.5 |
| Molecular Formula: | C20 H25 F N4 O3 S |
| Smiles: | Cc1cc(ccc1F)S(N1CCCC(C1)c1cc2C(N(C)CCCn2n1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8145 |
| logD: | 1.8145 |
| logSw: | -2.6112 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.741 |
| InChI Key: | QFNNIBVUCSWMGH-HNNXBMFYSA-N |