N-benzyl-4-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-benzyl-4-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
N-benzyl-4-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3754 |
| Compound Name: | N-benzyl-4-[2-{[(2,4-dimethylphenyl)methyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 471.62 |
| Molecular Formula: | C28 H29 N3 O2 S |
| Smiles: | Cc1ccc(CSC2=Nc3ccccc3C(N2CCCC(NCc2ccccc2)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.7457 |
| logD: | 4.7457 |
| logSw: | -4.3975 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.221 |
| InChI Key: | KUJPIXFVZGVKGA-UHFFFAOYSA-N |