3-(4-methoxyphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
3-(4-methoxyphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
Compound ID: | F067-0534 |
Compound Name: | 3-(4-methoxyphenyl)-4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide |
Molecular Weight: | 487.58 |
Molecular Formula: | C27 H25 N3 O4 S |
Smiles: | CC(C)NC(c1ccc2C(N(C(=Nc2c1)SCC(c1ccccc1)=O)c1ccc(cc1)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.5507 |
logD: | 3.5506 |
logSw: | -4.0013 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.609 |
InChI Key: | IBLXZUOVCLEZFS-UHFFFAOYSA-N |