N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061765 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C24 H27 N3 O5 S |
| Smiles: | COc1ccc(CCNC(c2ccc3C(N(CC4CCCO4)C(Nc3c2)=S)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9693 |
| logD: | 1.9666 |
| logSw: | -2.9071 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.488 |
| InChI Key: | FAYGTMSKASBYDE-QGZVFWFLSA-N |