5-ethyl-2-[1-(3-methoxybenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Chemical Structure Depiction of
5-ethyl-2-[1-(3-methoxybenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
5-ethyl-2-[1-(3-methoxybenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Compound characteristics
| Compound ID: | P223-1068 |
| Compound Name: | 5-ethyl-2-[1-(3-methoxybenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C21 H28 N4 O4 S |
| Smiles: | CCN1CCCn2c(cc(C3CCCN(C3)S(c3cccc(c3)OC)(=O)=O)n2)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1653 |
| logD: | 2.1653 |
| logSw: | -2.5848 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.295 |
| InChI Key: | RXJHDGWWVSVJHI-INIZCTEOSA-N |