2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(4-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]acetamide
Chemical Structure Depiction of
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(4-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]acetamide
2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(4-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | 3401-5446 |
| Compound Name: | 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(4-fluorophenyl)-4-oxoquinazolin-3(4H)-yl]acetamide |
| Molecular Weight: | 501.27 |
| Molecular Formula: | C20 H14 Br F N6 O4 |
| Smiles: | Cc1c(c(nn1CC(NN1C(c2ccc(cc2)F)=Nc2ccccc2C1=O)=O)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.6432 |
| logD: | 1.6429 |
| logSw: | -2.7509 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.829 |
| InChI Key: | XCOHDNFCFLCFIY-UHFFFAOYSA-N |