methyl 4-oxo-3-[(4-sulfamoylphenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 4-oxo-3-[(4-sulfamoylphenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 4-oxo-3-[(4-sulfamoylphenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | Y600-3017 |
| Compound Name: | methyl 4-oxo-3-[(4-sulfamoylphenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C17 H15 N3 O5 S2 |
| Smiles: | COC(c1ccc2C(N(Cc3ccc(cc3)S(N)(=O)=O)C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9101 |
| logD: | 1.9087 |
| logSw: | -2.9636 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.095 |
| InChI Key: | GVPVYWWOBJYQAB-UHFFFAOYSA-N |