{4-[7-(methoxycarbonyl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]phenyl}acetic acid
Chemical Structure Depiction of
{4-[7-(methoxycarbonyl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]phenyl}acetic acid
{4-[7-(methoxycarbonyl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]phenyl}acetic acid
Compound characteristics
| Compound ID: | F207-0052 |
| Compound Name: | {4-[7-(methoxycarbonyl)-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl]phenyl}acetic acid |
| Molecular Weight: | 370.38 |
| Molecular Formula: | C18 H14 N2 O5 S |
| Smiles: | COC(c1ccc2C(N(C(Nc2c1)=S)c1ccc(CC(O)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2359 |
| logD: | -0.8485 |
| logSw: | -3.0147 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.264 |
| InChI Key: | PXXFPKKWSQGIDD-UHFFFAOYSA-N |