N-(5-chloro-2,4-dimethoxyphenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide
Compound characteristics
| Compound ID: | C240-0027 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-8-oxo-5,8,13,13a-tetrahydro-6H-isoquinolino[3,2-a]isoquinoline-13-carboxamide |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C26 H23 Cl N2 O4 |
| Smiles: | COc1cc(c(cc1NC(C1C2c3ccccc3CCN2C(c2ccccc12)=O)=O)[Cl])OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6983 |
| logD: | 4.4038 |
| logSw: | -4.8581 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.6 |
| InChI Key: | KRBZILXUMCSLBR-UHFFFAOYSA-N |