N-[2-(cyclohex-1-en-1-yl)ethyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0645 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-1-(4-phenylpiperazin-1-yl)isoquinoline-7-carboxamide |
| Molecular Weight: | 440.59 |
| Molecular Formula: | C28 H32 N4 O |
| Smiles: | C1CCC(CCNC(c2ccc3ccnc(c3c2)N2CCN(CC2)c2ccccc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.2339 |
| logD: | 5.2203 |
| logSw: | -5.5232 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.107 |
| InChI Key: | SDKHYSIGALKIOE-UHFFFAOYSA-N |