4-methoxy-N-(3-methylbutyl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-methoxy-N-(3-methylbutyl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-methoxy-N-(3-methylbutyl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0051 |
| Compound Name: | 4-methoxy-N-(3-methylbutyl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C22 H29 N3 O2 |
| Smiles: | CC(C)CCNC(C1CCc2c(CC1)nc(c1ccccc1)nc2OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0135 |
| logD: | 5.0134 |
| logSw: | -4.5098 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.118 |
| InChI Key: | KVPGURDJZZNDFO-KRWDZBQOSA-N |