N-[2-(4-chlorophenyl)ethyl]-4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
N-[2-(4-chlorophenyl)ethyl]-4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C260-0992 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-{[1-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzamide |
| Molecular Weight: | 655.15 |
| Molecular Formula: | C36 H35 Cl N4 O6 |
| Smiles: | COc1ccc(CCNC(CN2C(N(Cc3ccc(cc3)C(NCCc3ccc(cc3)[Cl])=O)C(c3ccccc23)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6147 |
| logD: | 3.6147 |
| logSw: | -4.146 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.095 |
| InChI Key: | ZCQUHRKSKBDNAA-UHFFFAOYSA-N |