2-(1H-indol-3-yl)-1-{2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}ethan-1-one
Chemical Structure Depiction of
2-(1H-indol-3-yl)-1-{2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}ethan-1-one
2-(1H-indol-3-yl)-1-{2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}ethan-1-one
Compound characteristics
| Compound ID: | S029-0072 |
| Compound Name: | 2-(1H-indol-3-yl)-1-{2-[(2-methoxyethyl)amino]-4,5-dihydrospiro[[1,4]benzodiazepine-3,3'-pyrrolidin]-1'-yl}ethan-1-one |
| Molecular Weight: | 431.54 |
| Molecular Formula: | C25 H29 N5 O2 |
| Smiles: | COCCNC1C2(CCN(C2)C(Cc2c[nH]c3ccccc23)=O)NCc2ccccc2N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3533 |
| logD: | 2.3213 |
| logSw: | -2.7634 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.169 |
| InChI Key: | MPORFFPZJBNPTB-VWLOTQADSA-N |