5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
Chemical Structure Depiction of
5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
Compound characteristics
| Compound ID: | Y504-7466 |
| Compound Name: | 5-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid |
| Molecular Weight: | 284.23 |
| Molecular Formula: | C13 H8 N4 O4 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)c1cc(C(O)=O)n2c(ccn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9705 |
| logD: | -4.488 |
| logSw: | -2.0228 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.321 |
| InChI Key: | JMSMDWJYVBIFGA-UHFFFAOYSA-N |