1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol
TL;DR: 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol (CAS 106158-00-3) is a chemical compound with molecular formula C12H14ClN3O3 and molecular weight 283.07236 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-chloropentyl)-5-nitro-2H-indazol-3-one
Also Known As: 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol, 1-(5-chloropentyl)-5-nitroindazol-3-ol, 1-(5-chloropentyl)-5-nitro-2H-indazol-3-one
Technical Specifications
| Molecular Formula | C12H14ClN3O3 |
| Molecular Weight | 283.07236 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.07236 Da |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)NN2CCCCCCl |
| InChIKey | BRKUJQJRHIPBRB-UHFFFAOYSA-N |
Chemical Property Profile of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol
Property Insights of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol. Following Lipinski's Rule of Five, 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol?
The CAS number of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol is 106158-00-3.
What is the molecular formula of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol?
The molecular formula of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol is C12H14ClN3O3.
What is the molecular weight of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol?
The molecular weight of 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol is 283.07236 g/mol.
Where can I buy 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol?
You can request a quote for 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol?
Yes, CoreyChem provides custom synthesis services for 1-(5-chloropentyl)-5-nitro-1H-indazol-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.