2-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Chemical Structure Depiction of
2-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
2-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Compound characteristics
| Compound ID: | P223-0890 |
| Compound Name: | 2-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | [H]N1CCCn2c(cc(C3CCCN(C3)S(c3ccc(CC)cc3)(=O)=O)n2)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3412 |
| logD: | 2.3412 |
| logSw: | -2.8954 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.408 |
| InChI Key: | XZBMLJXQXQIEAR-INIZCTEOSA-N |