7,8-dimethoxy-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
7,8-dimethoxy-5-oxo-1-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
7,8-dimethoxy-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: | F083-0314 |
| Compound Name: | 7,8-dimethoxy-5-oxo-1-sulfanylidene-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 481.47 |
| Molecular Formula: | C20 H14 F3 N3 O4 S2 |
| Smiles: | COc1cc2C(NC3=C(C(Nc4cccc(c4)C(F)(F)F)=O)SC(N3c2cc1OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7944 |
| logD: | 3.7943 |
| logSw: | -4.2166 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.328 |
| InChI Key: | NIVRJQUBCYPZPC-UHFFFAOYSA-N |