N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamide
N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 6466-0218 |
| Compound Name: | N-{1-[(2-methylphenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 509.55 |
| Molecular Formula: | C26 H22 F3 N5 O S |
| Smiles: | Cc1ccccc1Cn1ccc(NC(CSc2nc3c4ccccc4CCc3c(C(F)(F)F)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.1042 |
| logD: | 6.1036 |
| logSw: | -5.4565 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.646 |
| InChI Key: | KIMFNLVSTDZCPL-UHFFFAOYSA-N |