methyl 1-[({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-[({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]-1H-pyrazole-3-carboxylate
methyl 1-[({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y502-4166 |
| Compound Name: | methyl 1-[({3-[(furan-2-yl)methyl]-4-oxo-3,4-dihydroquinazolin-2-yl}sulfanyl)methyl]-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C19 H16 N4 O4 S |
| Smiles: | COC(c1ccn(CSC2=Nc3ccccc3C(N2Cc2ccco2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1906 |
| logD: | 2.1906 |
| logSw: | -2.7856 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.482 |
| InChI Key: | ZOJQDRFLPUWATM-UHFFFAOYSA-N |