(isoquinolin-1-yl)(2'-methyl-2',3',4',9'-tetrahydrospiro[piperidine-4,1'-pyrido[3,4-b]indol]-1-yl)methanone
Chemical Structure Depiction of
(isoquinolin-1-yl)(2'-methyl-2',3',4',9'-tetrahydrospiro[piperidine-4,1'-pyrido[3,4-b]indol]-1-yl)methanone
(isoquinolin-1-yl)(2'-methyl-2',3',4',9'-tetrahydrospiro[piperidine-4,1'-pyrido[3,4-b]indol]-1-yl)methanone
Compound characteristics
| Compound ID: | S624-0179 |
| Compound Name: | (isoquinolin-1-yl)(2'-methyl-2',3',4',9'-tetrahydrospiro[piperidine-4,1'-pyrido[3,4-b]indol]-1-yl)methanone |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C26 H26 N4 O |
| Smiles: | CN1CCc2c3ccccc3[nH]c2C12CCN(CC2)C(c1c2ccccc2ccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4525 |
| logD: | 2.3918 |
| logSw: | -3.4301 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.29 |
| InChI Key: | CDAUJGAQGKNAHE-UHFFFAOYSA-N |