N-[(furan-2-yl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine
N-[(furan-2-yl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine
Compound characteristics
| Compound ID: | K297-0333 |
| Compound Name: | N-[(furan-2-yl)methyl]-2-{[(3-nitrophenyl)methyl]sulfanyl}quinazolin-4-amine |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C20 H16 N4 O3 S |
| Smiles: | C(c1ccco1)Nc1c2ccccc2nc(n1)SCc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2134 |
| logD: | 5.2117 |
| logSw: | -5.8183 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.98 |
| InChI Key: | UOUYKVUQWQMBNV-UHFFFAOYSA-N |