TL;DR: 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide (CAS 512810-12-7) is a chemical compound with molecular formula C8H13N5O3 and molecular weight 227.10184 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanehydrazide
Also Known As: 3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanehydrazide, 3-(3,5-dimethyl-4-nitropyrazolyl)propanohydrazide, 3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanehydrazide, 3-(3,5-DIMETHYL-4-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE, 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide
| Molecular Formula | C8H13N5O3 |
| Molecular Weight | 227.10184 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.10184 Da |
| Heavy Atoms | 16 |
| Complexity | 279.0 |
| SMILES | CC1=C(C(=NN1CCC(=O)NN)C)[N+](=O)[O-] |
| InChIKey | BCABNIRNBURSJH-UHFFFAOYSA-N |
The XLogP value of -0.7 indicates that 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide. Following Lipinski's Rule of Five, 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide is 512810-12-7.
The molecular formula of 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide is C8H13N5O3.
The molecular weight of 3,5-Dimethyl-4-nitro-1H-pyrazole-1-propanoic acid hydrazide is 227.10184 g/mol.
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