N-[2-(4-chlorophenyl)ethyl]-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
N-[2-(4-chlorophenyl)ethyl]-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C260-1005 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-{[1-(3,3-dimethyl-2-oxobutyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide |
| Molecular Weight: | 532.04 |
| Molecular Formula: | C30 H30 Cl N3 O4 |
| Smiles: | CC(C)(C)C(CN1C(N(Cc2ccc(cc2)C(NCCc2ccc(cc2)[Cl])=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6601 |
| logD: | 4.6601 |
| logSw: | -4.7977 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.04 |
| InChI Key: | AJGLHSCVOGCEPI-UHFFFAOYSA-N |