4-{1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
4-{1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
4-{1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | C260-2734 |
| Compound Name: | 4-{1-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 577.48 |
| Molecular Formula: | C29 H29 Br N4 O4 |
| Smiles: | Cc1ccc(CNC(CCCN2C(c3ccccc3N(CC(Nc3ccc(c(C)c3)[Br])=O)C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2624 |
| logD: | 4.2623 |
| logSw: | -4.2195 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.866 |
| InChI Key: | YWJNBGYRIJTXON-UHFFFAOYSA-N |