N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | 3909-9961 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinoline-4-carboxamide |
| Molecular Weight: | 533.03 |
| Molecular Formula: | C29 H29 Cl N4 O4 |
| Smiles: | COc1cc(c(cc1NC(c1cnc(c2ccccc12)N1CCN(CC1)c1ccccc1OC)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.862 |
| logD: | 5.854 |
| logSw: | -5.975 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.734 |
| InChI Key: | FWCDSMGUCNHHNZ-UHFFFAOYSA-N |