5-ethyl-2-[1-(2-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
5-ethyl-2-[1-(2-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
5-ethyl-2-[1-(2-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: | P223-1062 |
| Compound Name: | 5-ethyl-2-[1-(2-ethylbenzene-1-sulfonyl)piperidin-3-yl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one |
| Molecular Weight: | 430.57 |
| Molecular Formula: | C22 H30 N4 O3 S |
| Smiles: | CCc1ccccc1S(N1CCCC(C1)c1cc2C(N(CC)CCCn2n1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8314 |
| logD: | 2.8314 |
| logSw: | -3.1569 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.751 |
| InChI Key: | JCUBYCSVXJRUQG-SFHVURJKSA-N |