5-{1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(3-methylbutyl)pentanamide
Chemical Structure Depiction of
5-{1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(3-methylbutyl)pentanamide
5-{1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(3-methylbutyl)pentanamide
Compound characteristics
| Compound ID: | F142-0166 |
| Compound Name: | 5-{1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-(3-methylbutyl)pentanamide |
| Molecular Weight: | 513.04 |
| Molecular Formula: | C27 H33 Cl N4 O4 |
| Smiles: | CC(C)CCNC(CCCCN1C(c2ccccc2N(CC(Nc2cccc(c2C)[Cl])=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8536 |
| logD: | 3.8534 |
| logSw: | -4.1392 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.281 |
| InChI Key: | KNSMYZFUJBMMAD-UHFFFAOYSA-N |