4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide
4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-4224 |
| Compound Name: | 4-{2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C27 H32 N4 O4 S |
| Smiles: | Cc1ccc(CNC(CSC2=Nc3ccccc3C(N2CCCC(NCC2CCCO2)=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6151 |
| logD: | 1.6151 |
| logSw: | -2.5956 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.347 |
| InChI Key: | KCCWBNXZYUWSKG-OAQYLSRUSA-N |