methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-2064 |
| Compound Name: | methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 605.67 |
| Molecular Formula: | C31 H31 N3 O8 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1=Nc2cc(ccc2C(N1CCc1ccc(c(c1)OC)OC)=O)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6746 |
| logD: | 4.6745 |
| logSw: | -4.3149 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.087 |
| InChI Key: | LLODSKGWZMBJEZ-UHFFFAOYSA-N |