{4-[benzyl(methyl)amino]-1-oxa-9-azaspiro[5.5]undecan-9-yl}(isoquinolin-1-yl)methanone
Chemical Structure Depiction of
{4-[benzyl(methyl)amino]-1-oxa-9-azaspiro[5.5]undecan-9-yl}(isoquinolin-1-yl)methanone
{4-[benzyl(methyl)amino]-1-oxa-9-azaspiro[5.5]undecan-9-yl}(isoquinolin-1-yl)methanone
Compound characteristics
| Compound ID: | S431-0566 |
| Compound Name: | {4-[benzyl(methyl)amino]-1-oxa-9-azaspiro[5.5]undecan-9-yl}(isoquinolin-1-yl)methanone |
| Molecular Weight: | 429.56 |
| Molecular Formula: | C27 H31 N3 O2 |
| Smiles: | CN(Cc1ccccc1)C1CCOC2(CCN(CC2)C(c2c3ccccc3ccn2)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3814 |
| logD: | 2.656 |
| logSw: | -3.2643 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.631 |
| InChI Key: | HBBHLVYYVSZVFM-HSZRJFAPSA-N |