4-ethoxy-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-ethoxy-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-ethoxy-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0488 |
| Compound Name: | 4-ethoxy-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C26 H33 N5 O2 |
| Smiles: | CCn1c(C)c(CNC(C2CCc3c(CC2)nc(c2ccccc2)nc3OCC)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.461 |
| logD: | 4.461 |
| logSw: | -4.2068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.863 |
| InChI Key: | UAJPOTKXXWSJNG-FQEVSTJZSA-N |