4-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(3-chlorophenyl)methyl]butanamide
Chemical Structure Depiction of
4-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(3-chlorophenyl)methyl]butanamide
4-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(3-chlorophenyl)methyl]butanamide
Compound characteristics
| Compound ID: | K284-3371 |
| Compound Name: | 4-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]-N-[(3-chlorophenyl)methyl]butanamide |
| Molecular Weight: | 535.06 |
| Molecular Formula: | C28 H27 Cl N4 O3 S |
| Smiles: | C(CC(NCc1cccc(c1)[Cl])=O)CN1C(=Nc2ccccc2C1=O)SCC(NCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4336 |
| logD: | 3.4336 |
| logSw: | -3.9644 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.692 |
| InChI Key: | DRDFKDQJTWDMCT-UHFFFAOYSA-N |