[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](2,6-dimethoxypyridin-3-yl)methanone
Chemical Structure Depiction of
[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](2,6-dimethoxypyridin-3-yl)methanone
[2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](2,6-dimethoxypyridin-3-yl)methanone
Compound characteristics
| Compound ID: | S029-0782 |
| Compound Name: | [2-(cyclopentylamino)-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl](2,6-dimethoxypyridin-3-yl)methanone |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C25 H31 N5 O3 |
| Smiles: | COc1ccc(C(N2CCC3(C2)C(NC2CCCC2)=Nc2ccccc2CN3)=O)c(n1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5719 |
| logD: | 3.5106 |
| logSw: | -3.7774 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.822 |
| InChI Key: | MYQNMPRCQJFQIN-VWLOTQADSA-N |