N-[2-(1H-imidazol-1-yl)ethyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[2-(1H-imidazol-1-yl)ethyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
N-[2-(1H-imidazol-1-yl)ethyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0217 |
| Compound Name: | N-[2-(1H-imidazol-1-yl)ethyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C22 H25 N5 O2 |
| Smiles: | COc1c2CCC(CCc2nc(c2ccccc2)n1)C(NCCn1ccnc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0698 |
| logD: | 2.9238 |
| logSw: | -3.065 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.647 |
| InChI Key: | CDDIURWNZFRIHV-KRWDZBQOSA-N |