N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K284-4231 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({4-oxo-3-[4-oxo-4-(pyrrolidin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 538.67 |
| Molecular Formula: | C28 H34 N4 O5 S |
| Smiles: | COc1ccc(CCNC(CSC2=Nc3ccccc3C(N2CCCC(N2CCCC2)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.5145 |
| logD: | 1.5145 |
| logSw: | -2.5327 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.082 |
| InChI Key: | NMQXBLLYVNJBPH-UHFFFAOYSA-N |