N-[(furan-2-yl)methyl]-3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[(furan-2-yl)methyl]-3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0455 |
| Compound Name: | N-[(furan-2-yl)methyl]-3-[(2-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C22 H19 N3 O4 S |
| Smiles: | COc1ccccc1CN1C(c2ccc(cc2NC1=S)C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7786 |
| logD: | 3.7777 |
| logSw: | -4.0076 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.11 |
| InChI Key: | NTHWNCZTPVKLGI-UHFFFAOYSA-N |