11-[(3-methylbutyl)amino]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile
Chemical Structure Depiction of
11-[(3-methylbutyl)amino]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile
11-[(3-methylbutyl)amino]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile
Compound characteristics
| Compound ID: | D724-0073 |
| Compound Name: | 11-[(3-methylbutyl)amino]-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile |
| Molecular Weight: | 332.45 |
| Molecular Formula: | C21 H24 N4 |
| Smiles: | CC(C)CCNC1=C2CCCCC2=C(C#N)c2nc3ccccc3n12 |
| Stereo: | ACHIRAL |
| logP: | 4.8641 |
| logD: | 4.8641 |
| logSw: | -4.4163 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.025 |
| InChI Key: | MKCBANYWVZNAIA-UHFFFAOYSA-N |