(1,5-dimethyl-1H-pyrazol-3-yl)[rel-(5R,8S)-2-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl]methanone
Chemical Structure Depiction of
(1,5-dimethyl-1H-pyrazol-3-yl)[rel-(5R,8S)-2-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl]methanone
(1,5-dimethyl-1H-pyrazol-3-yl)[rel-(5R,8S)-2-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl]methanone
Compound characteristics
| Compound ID: | S572-0730 |
| Compound Name: | (1,5-dimethyl-1H-pyrazol-3-yl)[rel-(5R,8S)-2-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-5,8-epiminocyclohepta[d]pyrimidin-10-yl]methanone |
| Molecular Weight: | 377.42 |
| Molecular Formula: | C21 H20 F N5 O |
| Smiles: | Cc1cc(C(N2[C@H]3CC[C@@H]2c2cnc(c4ccc(cc4)F)nc2C3)=O)nn1C |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4099 |
| logD: | 2.4099 |
| logSw: | -2.7523 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.12 |
| InChI Key: | CEOQQQQJPKWPFJ-KXBFYZLASA-N |