N-(4-bromo-2-fluorophenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
N-(4-bromo-2-fluorophenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0446 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 464.33 |
| Molecular Formula: | C18 H11 Br F N3 O2 S2 |
| Smiles: | Cc1ccc2c(c1)C(NC1=C(C(Nc3ccc(cc3F)[Br])=O)SC(N12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2097 |
| logD: | 4.2081 |
| logSw: | -4.3269 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.369 |
| InChI Key: | MZDLLGIEVUVNCX-UHFFFAOYSA-N |