N-[(2,3-dimethoxyphenyl)methyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
N-[(2,3-dimethoxyphenyl)methyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0160 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H29 N3 O4 |
| Smiles: | COc1cccc(CNC(C2CCc3c(CC2)nc(c2ccccc2)nc3OC)=O)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8879 |
| logD: | 4.8879 |
| logSw: | -4.673 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.353 |
| InChI Key: | RMKJEQQWIFLHOB-SFHVURJKSA-N |