methyl 4-oxo-3-[2-oxo-2-(propylamino)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-3-[2-oxo-2-(propylamino)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 4-oxo-3-[2-oxo-2-(propylamino)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
Compound ID: | F207-0086 |
Compound Name: | methyl 4-oxo-3-[2-oxo-2-(propylamino)ethyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
Molecular Weight: | 335.38 |
Molecular Formula: | C15 H17 N3 O4 S |
Smiles: | CCCNC(CN1C(c2ccc(cc2NC1=S)C(=O)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6001 |
logD: | 1.5979 |
logSw: | -2.6981 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.076 |
InChI Key: | WQVGDTLXXFIPFB-UHFFFAOYSA-N |