N-[(2-chlorophenyl)methyl]-4-[1-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]butanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-[1-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]butanamide
N-[(2-chlorophenyl)methyl]-4-[1-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]butanamide
Compound characteristics
| Compound ID: | C260-2233 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-[1-{2-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]butanamide |
| Molecular Weight: | 563.01 |
| Molecular Formula: | C29 H27 Cl N4 O6 |
| Smiles: | C(CC(NCc1ccccc1[Cl])=O)CN1C(c2ccccc2N(CC(Nc2ccc3c(c2)OCCO3)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.419 |
| logD: | 2.419 |
| logSw: | -3.5398 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.689 |
| InChI Key: | VPXOKCHTTGDMRM-UHFFFAOYSA-N |