N-benzyl-4-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-benzyl-4-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
N-benzyl-4-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3763 |
| Compound Name: | N-benzyl-4-[2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 535.06 |
| Molecular Formula: | C28 H27 Cl N4 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSC1=Nc2ccccc2C(N1CCCC(NCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4452 |
| logD: | 4.4451 |
| logSw: | -4.5906 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.37 |
| InChI Key: | GVICAUOCZKIWQL-UHFFFAOYSA-N |