methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K284-2059 |
| Compound Name: | methyl 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[2-(4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 547.63 |
| Molecular Formula: | C29 H29 N3 O6 S |
| Smiles: | Cc1ccc(cc1)NC(CSC1=Nc2cc(ccc2C(N1CCc1ccc(c(c1)OC)OC)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4966 |
| logD: | 4.4966 |
| logSw: | -4.2151 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.333 |
| InChI Key: | HPZGCDZITQKVJJ-UHFFFAOYSA-N |