methyl 4-oxo-2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 4-oxo-2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | F207-0026 |
| Compound Name: | methyl 4-oxo-2-sulfanylidene-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 402.42 |
| Molecular Formula: | C19 H18 N2 O6 S |
| Smiles: | COC(c1ccc2C(N(C(Nc2c1)=S)c1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7198 |
| logD: | 2.7144 |
| logSw: | -3.491 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.858 |
| InChI Key: | WHTFPWSKJSHRRN-UHFFFAOYSA-N |