N-benzyl-3-(2,5-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-benzyl-3-(2,5-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-benzyl-3-(2,5-dimethoxyphenyl)-N-methyl-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0060924 |
| Compound Name: | N-benzyl-3-(2,5-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)c1cc(ccc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8164 |
| logD: | 3.8161 |
| logSw: | -4.0869 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.73 |
| InChI Key: | OSXAJNLLNVOSRG-UHFFFAOYSA-N |