3-(4-chlorophenyl)-5-(3-fluorophenyl)-6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[e]pyrazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
3-(4-chlorophenyl)-5-(3-fluorophenyl)-6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[e]pyrazolo[1,5-a]pyrimidine
3-(4-chlorophenyl)-5-(3-fluorophenyl)-6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[e]pyrazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | 8019-9713 |
| Compound Name: | 3-(4-chlorophenyl)-5-(3-fluorophenyl)-6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[e]pyrazolo[1,5-a]pyrimidine |
| Molecular Weight: | 462.01 |
| Molecular Formula: | C28 H29 Cl F N3 |
| Smiles: | C1CCCCCC2=C(CCCC1)C(c1cccc(c1)F)=Nc1c(cnn12)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 9.1373 |
| logD: | 9.1373 |
| logSw: | -7.1548 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 21.2658 |
| InChI Key: | OYYWMABLUSHMRM-UHFFFAOYSA-N |