11-chloro-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
Chemical Structure Depiction of
11-chloro-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
11-chloro-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
Compound characteristics
| Compound ID: | 6049-2177 |
| Compound Name: | 11-chloro-N-{3,5-dimethyl-1-[(2-methylphenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide |
| Molecular Weight: | 565 |
| Molecular Formula: | C29 H24 Cl F3 N6 O |
| Smiles: | Cc1ccccc1Cn1c(C)c(c(C)n1)NC(c1c(c2N=C3C(CCc4ccccc34)=C(C(F)(F)F)n2n1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9071 |
| logD: | 5.8988 |
| logSw: | -6.0235 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.452 |
| InChI Key: | XPJPFJQISDHGRL-UHFFFAOYSA-N |