3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
Chemical Structure Depiction of
3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
Compound characteristics
| Compound ID: | Y504-7825 |
| Compound Name: | 3-bromo-5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid |
| Molecular Weight: | 363.12 |
| Molecular Formula: | C13 H7 Br N4 O4 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)c1cc(C(O)=O)n2c(c(cn2)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6931 |
| logD: | -3.8813 |
| logSw: | -2.6633 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.957 |
| InChI Key: | AKPHVZLTEOTREC-UHFFFAOYSA-N |