N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[2-(4-bromophenyl)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[2-(4-bromophenyl)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[2-(4-bromophenyl)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Compound characteristics
| Compound ID: | C260-1013 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-{1-[2-(4-bromophenyl)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide |
| Molecular Weight: | 592.45 |
| Molecular Formula: | C29 H26 Br N3 O6 |
| Smiles: | C(CCN1C(c2ccccc2N(CC(c2ccc(cc2)[Br])=O)C1=O)=O)CC(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8693 |
| logD: | 3.8693 |
| logSw: | -4.1397 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.079 |
| InChI Key: | LZHNIZUITICPKX-UHFFFAOYSA-N |