4-(cyclopropylmethoxy)-N-[2-(methylsulfanyl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-(cyclopropylmethoxy)-N-[2-(methylsulfanyl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-(cyclopropylmethoxy)-N-[2-(methylsulfanyl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0337 |
| Compound Name: | 4-(cyclopropylmethoxy)-N-[2-(methylsulfanyl)ethyl]-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 411.57 |
| Molecular Formula: | C23 H29 N3 O2 S |
| Smiles: | CSCCNC(C1CCc2c(CC1)nc(c1ccccc1)nc2OCC1CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8505 |
| logD: | 4.8505 |
| logSw: | -4.5457 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.325 |
| InChI Key: | YPDPOQRNTHZSOL-SFHVURJKSA-N |