3-(4-fluorophenyl)-4-oxo-2-sulfanylidene-N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-4-oxo-2-sulfanylidene-N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-(4-fluorophenyl)-4-oxo-2-sulfanylidene-N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061810 |
| Compound Name: | 3-(4-fluorophenyl)-4-oxo-2-sulfanylidene-N-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C24 H20 F N3 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(c1ccc2C(N(C(Nc2c1)=S)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2284 |
| logD: | 3.1718 |
| logSw: | -3.676 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.775 |
| InChI Key: | BWNXCLNBJOBEEZ-UHFFFAOYSA-N |