methyl 2-[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K289-0269 |
| Compound Name: | methyl 2-[(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-3-(2-methoxyethyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 475.95 |
| Molecular Formula: | C22 H22 Cl N3 O5 S |
| Smiles: | COCCN1C(=Nc2cc(ccc2C1=O)C(=O)OC)SCC(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1393 |
| logD: | 3.1393 |
| logSw: | -3.5873 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.009 |
| InChI Key: | FZCMXLZWDLMKBK-UHFFFAOYSA-N |