3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
Chemical Structure Depiction of
3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
Compound characteristics
| Compound ID: | Y504-7826 |
| Compound Name: | 3-bromo-2-methyl-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid |
| Molecular Weight: | 377.15 |
| Molecular Formula: | C14 H9 Br N4 O4 |
| Smiles: | Cc1c(c2nc(cc(C(O)=O)n2n1)c1cccc(c1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.869 |
| logD: | -3.5045 |
| logSw: | -3.0312 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.31 |
| InChI Key: | SFQCBUQKUMBDJH-UHFFFAOYSA-N |