![3-Nitro-1H-pyrrolo[3,2-c]pyridine structure](/static/products/7772/7772-87-4.webp)
3-Nitro-1H-pyrrolo[3,2-c]pyridine
TL;DR: 3-Nitro-1H-pyrrolo[3,2-c]pyridine (CAS 7772-87-4) is a chemical compound with molecular formula C20H20ClNO9 and molecular weight 453.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4-diacetyloxy-6-chloro-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate
Also Known As: 3-Nitro-1H-pyrrolo[3,2-c]pyridine, [3,4-diacetyloxy-6-chloro-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl Acetate, (2R,3S,4R,5R,6S)-2-(Acetoxymethyl)-6-chloro-5-(1,3-dioxoisoindolin-2-yl)tetrahydro-2H-pyran-3,4-diyl diacetate, [(2R,3S,4R,5R,6S)-3,4-bis(acetyloxy)-6-chloro-5-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxan-2-yl]methyl acetate
| Molecular Formula | C20H20ClNO9 |
|---|---|
| Molecular Weight | 453.08 g/mol |
| LogP | 1.0414 |
| Topological Polar Surface Area | 125.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.08267 |
| Heavy Atoms | 31 |
| Complexity | 897.9805 |
Chemical Identifiers
| CAS Number | 7772-87-4 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)Cl)N2C(=O)C3=CC=CC=C3C2=O)OC(=O)C)OC(=O)C |
Product Overview
3-Nitro-1H-pyrrolo[3,2-c]pyridine (CAS 7772-87-4), with molecular formula C20H20ClNO9 and molecular weight 453.08 g/mol. IUPAC: [3,4-diacetyloxy-6-chloro-5-(1,3-dioxoisoindol-2-yl)oxan-2-yl]methyl acetate.
Chemical Property Profile of 3-Nitro-1H-pyrrolo[3,2-c]pyridine
Property Insights of 3-Nitro-1H-pyrrolo[3,2-c]pyridine
The XLogP value of 1.0414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-1H-pyrrolo[3,2-c]pyridine. The TPSA of 125.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-1H-pyrrolo[3,2-c]pyridine. Following Lipinski's Rule of Five, 3-Nitro-1H-pyrrolo[3,2-c]pyridine has 0 hydrogen bond donor(s) and 9 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 3-Nitro-1H-pyrrolo[3,2-c]pyridine?
The CAS number of 3-Nitro-1H-pyrrolo[3,2-c]pyridine is 7772-87-4.
What is the molecular formula of 3-Nitro-1H-pyrrolo[3,2-c]pyridine?
The molecular formula of 3-Nitro-1H-pyrrolo[3,2-c]pyridine is C20H20ClNO9.
What is the molecular weight of 3-Nitro-1H-pyrrolo[3,2-c]pyridine?
The molecular weight of 3-Nitro-1H-pyrrolo[3,2-c]pyridine is 453.08 g/mol.
Where can I buy 3-Nitro-1H-pyrrolo[3,2-c]pyridine?
You can request a quote for 3-Nitro-1H-pyrrolo[3,2-c]pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-1H-pyrrolo[3,2-c]pyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-1H-pyrrolo[3,2-c]pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.