methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxylate
methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-2080 |
| Compound Name: | methyl 2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 525.58 |
| Molecular Formula: | C26 H27 N3 O7 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1=Nc2cc(ccc2C(N1CC1CCCO1)=O)C(=O)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5012 |
| logD: | 3.5011 |
| logSw: | -3.8462 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.502 |
| InChI Key: | PYWDUBUZJHFRAB-LJQANCHMSA-N |