N-[(2-chlorophenyl)methyl]-5-{1-[2-(cyclohexylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-5-{1-[2-(cyclohexylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
N-[(2-chlorophenyl)methyl]-5-{1-[2-(cyclohexylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide
Compound characteristics
| Compound ID: | K221-3221 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-5-{1-[2-(cyclohexylamino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}pentanamide |
| Molecular Weight: | 525.05 |
| Molecular Formula: | C28 H33 Cl N4 O4 |
| Smiles: | C1CCC(CC1)NC(CN1C(N(CCCCC(NCc2ccccc2[Cl])=O)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7596 |
| logD: | 3.7596 |
| logSw: | -4.2332 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.913 |
| InChI Key: | JHPCVMQVSQLUIT-UHFFFAOYSA-N |