N-(3-chloro-4-methylphenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-(3-chloro-4-methylphenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061705 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 425.89 |
| Molecular Formula: | C21 H16 Cl N3 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1ccc2C(N(Cc3ccco3)C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0537 |
| logD: | 5.0436 |
| logSw: | -5.0944 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.158 |
| InChI Key: | MREUUTPIOGALPK-UHFFFAOYSA-N |