N-(3-chloro-4-fluorophenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-(3-chloro-4-fluorophenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061710 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 429.86 |
| Molecular Formula: | C20 H13 Cl F N3 O3 S |
| Smiles: | C(c1ccco1)N1C(c2ccc(cc2NC1=S)C(Nc1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3936 |
| logD: | 4.0688 |
| logSw: | -4.6231 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.158 |
| InChI Key: | SJXIKNQZGTZBLY-UHFFFAOYSA-N |