N-(1-benzylpiperidin-4-yl)-4-{1-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-4-{1-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide
N-(1-benzylpiperidin-4-yl)-4-{1-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide
Compound characteristics
| Compound ID: | C260-1196 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-4-{1-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}butanamide |
| Molecular Weight: | 602.13 |
| Molecular Formula: | C33 H36 Cl N5 O4 |
| Smiles: | Cc1ccc(cc1NC(CN1C(N(CCCC(NC2CCN(CC2)Cc2ccccc2)=O)C(c2ccccc12)=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3698 |
| logD: | 1.8121 |
| logSw: | -3.8778 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.434 |
| InChI Key: | QTNVXSGDWYZDKM-UHFFFAOYSA-N |