N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | 3401-5447 |
| Compound Name: | N-[2-(3-chlorophenyl)-4-oxoquinazolin-3(4H)-yl]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 452.86 |
| Molecular Formula: | C21 H17 Cl N6 O4 |
| Smiles: | Cc1c(c(C)n(CC(NN2C(c3cccc(c3)[Cl])=Nc3ccccc3C2=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7435 |
| logD: | 1.7418 |
| logSw: | -3.1609 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.871 |
| InChI Key: | NCTGBMPLBGQWQR-UHFFFAOYSA-N |