6-methyl-2-(2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
6-methyl-2-(2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
6-methyl-2-(2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 6466-0204 |
| Compound Name: | 6-methyl-2-(2-{[4-(trifluoromethyl)-5,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 532.61 |
| Molecular Formula: | C25 H23 F3 N4 O2 S2 |
| Smiles: | CC1CCc2c(C(N)=O)c(NC(CSc3nc4c5ccccc5CCc4c(C(F)(F)F)n3)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8304 |
| logD: | 4.5537 |
| logSw: | -4.7584 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.464 |
| InChI Key: | WQPFNKXTBGSAPJ-GFCCVEGCSA-N |