N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
Chemical Structure Depiction of
N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
Compound characteristics
| Compound ID: | Y500-5700 |
| Compound Name: | N-{3-bromo-1-[(4-chlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide |
| Molecular Weight: | 601.81 |
| Molecular Formula: | C26 H17 Br Cl F3 N6 O |
| Smiles: | C1Cc2ccccc2C2C1=C(C(F)(F)F)n1c(cc(C(Nc3cn(Cc4ccc(cc4)[Cl])nc3[Br])=O)n1)N=2 |
| Stereo: | ACHIRAL |
| logP: | 6.0695 |
| logD: | 6.0489 |
| logSw: | -6.2853 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.976 |
| InChI Key: | CWWUSMLKJIBPSE-UHFFFAOYSA-N |