N-[(2-chlorophenyl)methyl]-5-[1-{2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]pentanamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-5-[1-{2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]pentanamide
N-[(2-chlorophenyl)methyl]-5-[1-{2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]pentanamide
Compound characteristics
| Compound ID: | C260-2084 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-5-[1-{2-[(3-methyl-1H-pyrazol-5-yl)amino]-2-oxoethyl}-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]pentanamide |
| Molecular Weight: | 522.99 |
| Molecular Formula: | C26 H27 Cl N6 O4 |
| Smiles: | Cc1cc(NC(CN2C(N(CCCCC(NCc3ccccc3[Cl])=O)C(c3ccccc23)=O)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4295 |
| logD: | 2.429 |
| logSw: | -3.4926 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102 |
| InChI Key: | JXEVVWJUKXKVPJ-UHFFFAOYSA-N |