4-methoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-methoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-methoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0187 |
| Compound Name: | 4-methoxy-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 423.56 |
| Molecular Formula: | C24 H33 N5 O2 |
| Smiles: | CN1CCN(CCNC(C2CCc3c(CC2)nc(c2ccccc2)nc3OC)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9726 |
| logD: | 2.3051 |
| logSw: | -3.2109 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.306 |
| InChI Key: | PLQWRVOUCOUNKC-IBGZPJMESA-N |