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2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine
TL;DR: 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine (CAS 23616-50-4) is a chemical compound with molecular formula C8H7N3O2 and molecular weight 177.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine
Also Known As: 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine, 1H-Pyrrolo[2,3-b]pyridine, 2-methyl-3-nitro-, 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine #
| Molecular Formula | C8H7N3O2 |
|---|---|
| Molecular Weight | 177.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.05383 |
| Heavy Atoms | 13 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 23616-50-4 |
|---|---|
| SMILES | CC1=C(C2=C(N1)N=CC=C2)[N+](=O)[O-] |
| InChIKey | CGNIQMDWUOFQJO-UHFFFAOYSA-N |
Product Overview
2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine (CAS 23616-50-4), with molecular formula C8H7N3O2 and molecular weight 177.05 g/mol. IUPAC: 2-methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine.
Chemical Property Profile of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine
Property Insights of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine. Following Lipinski's Rule of Five, 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine?
The CAS number of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine is 23616-50-4.
What is the molecular formula of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine?
The molecular formula of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine is C8H7N3O2.
What is the molecular weight of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine?
The molecular weight of 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine is 177.05 g/mol.
Where can I buy 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine?
You can request a quote for 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-nitro-1H-pyrrolo[2,3-b]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.