N-benzyl-3-(3,4-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-benzyl-3-(3,4-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-benzyl-3-(3,4-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061104 |
| Compound Name: | N-benzyl-3-(3,4-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C25 H23 N3 O4 S |
| Smiles: | CN(Cc1ccccc1)C(c1ccc2C(N(C(Nc2c1)=S)c1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2815 |
| logD: | 3.2802 |
| logSw: | -3.6125 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.118 |
| InChI Key: | NMGGYGDWLYPAMM-UHFFFAOYSA-N |