7-bromo-5-oxo-1-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
7-bromo-5-oxo-1-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
7-bromo-5-oxo-1-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0252 |
| Compound Name: | 7-bromo-5-oxo-1-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 500.31 |
| Molecular Formula: | C18 H9 Br F3 N3 O2 S2 |
| Smiles: | c1cc(cc(c1)NC(C1=C2NC(c3cc(ccc3N2C(=S)S1)[Br])=O)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.8451 |
| logD: | 4.845 |
| logSw: | -4.8241 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.067 |
| InChI Key: | ZPZNATOWAPNYBM-UHFFFAOYSA-N |