[2-(3,4-dimethylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl]methanone
Chemical Structure Depiction of
[2-(3,4-dimethylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl]methanone
[2-(3,4-dimethylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl]methanone
Compound characteristics
| Compound ID: | P218-3107 |
| Compound Name: | [2-(3,4-dimethylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl][1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-3-yl]methanone |
| Molecular Weight: | 524.69 |
| Molecular Formula: | C27 H36 N6 O3 S |
| Smiles: | Cc1ccc(cc1C)c1cc2CN(CCCn2n1)C(C1CCCN(C1)S(c1c(C)nn(C)c1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3398 |
| logD: | 2.3398 |
| logSw: | -2.7549 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 76.901 |
| InChI Key: | TZQWXXSCTBBIFZ-QHCPKHFHSA-N |