N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | 3909-9823 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxamide |
| Molecular Weight: | 503.99 |
| Molecular Formula: | C27 H26 Cl N5 O3 |
| Smiles: | COc1cc(c(cc1NC(c1cnc(c2ccccc12)N1CCN(CC1)c1ccccn1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.5289 |
| logD: | 5.5163 |
| logSw: | -5.9414 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.916 |
| InChI Key: | SLMOIKWYNLCRGX-UHFFFAOYSA-N |