[rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl][4-(propan-2-yl)phenyl]methanone
Chemical Structure Depiction of
[rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl][4-(propan-2-yl)phenyl]methanone
[rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl][4-(propan-2-yl)phenyl]methanone
Compound characteristics
| Compound ID: | S572-0225 |
| Compound Name: | [rel-(5R,8S)-2-methyl-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl][4-(propan-2-yl)phenyl]methanone |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C20 H23 N3 O |
| Smiles: | CC(C)c1ccc(cc1)C(N1[C@H]2CC[C@@H]1c1cnc(C)nc1C2)=O |
| Stereo: | RELATIVE |
| logP: | 3.0681 |
| logD: | 3.0681 |
| logSw: | -2.9009 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.517 |
| InChI Key: | FDJARSFMFIJTSH-APWZRJJASA-N |