methyl 3-(2,2-diphenylacetamido)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(2,2-diphenylacetamido)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-(2,2-diphenylacetamido)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | Y600-3025 |
| Compound Name: | methyl 3-(2,2-diphenylacetamido)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 445.5 |
| Molecular Formula: | C24 H19 N3 O4 S |
| Smiles: | COC(c1ccc2C(N(C(Nc2c1)=S)NC(C(c1ccccc1)c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8048 |
| logD: | 1.5022 |
| logSw: | -4.2102 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.621 |
| InChI Key: | ISNPTKGGYIMYOT-UHFFFAOYSA-N |