methyl 4-oxo-3-[(4-{[(oxolan-2-yl)methyl]carbamoyl}phenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-3-[(4-{[(oxolan-2-yl)methyl]carbamoyl}phenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 4-oxo-3-[(4-{[(oxolan-2-yl)methyl]carbamoyl}phenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | F207-0475 |
| Compound Name: | methyl 4-oxo-3-[(4-{[(oxolan-2-yl)methyl]carbamoyl}phenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C23 H23 N3 O5 S |
| Smiles: | COC(c1ccc2C(N(Cc3ccc(cc3)C(NCC3CCCO3)=O)C(Nc2c1)=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.597 |
| logD: | 2.5957 |
| logSw: | -3.2453 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.559 |
| InChI Key: | GGYUMTZLRRALHU-QGZVFWFLSA-N |