N-[(furan-2-yl)methyl]-4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}butanamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}butanamide
N-[(furan-2-yl)methyl]-4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}butanamide
Compound characteristics
| Compound ID: | K284-4644 |
| Compound Name: | N-[(furan-2-yl)methyl]-4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}butanamide |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C27 H28 N4 O4 S |
| Smiles: | Cc1ccc(CNC(CSC2=Nc3ccccc3C(N2CCCC(NCc2ccco2)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9103 |
| logD: | 2.9103 |
| logSw: | -3.6401 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.441 |
| InChI Key: | USMBMCAMGXKNSO-UHFFFAOYSA-N |