![3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile structure](/static/products/3391/339107-08-3.webp)
3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile
TL;DR: 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile (CAS 339107-08-3) is a chemical compound with molecular formula C20H13N3O3 and molecular weight 343.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-nitrophenyl)methoxy]pyrido[1,2-a]indole-10-carbonitrile
Also Known As: 3-[(4-nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile, 3-[(4-nitrophenyl)methoxy]pyrido[1,2-a]indole-10-carbonitrile, 8N-817
| Molecular Formula | C20H13N3O3 |
|---|---|
| Molecular Weight | 343.10 g/mol |
| LogP | 4.45138 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.0957 |
| Heavy Atoms | 26 |
| Complexity | 1170.8196 |
Chemical Identifiers
| CAS Number | 339107-08-3 |
|---|---|
| SMILES | C1=CC2=C(C3=C(N2C=C1)C=C(C=C3)OCC4=CC=C(C=C4)[N+](=O)[O-])C#N |
Product Overview
3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile (CAS 339107-08-3), with molecular formula C20H13N3O3 and molecular weight 343.10 g/mol. IUPAC: 3-[(4-nitrophenyl)methoxy]pyrido[1,2-a]indole-10-carbonitrile.
Chemical Property Profile of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile
Property Insights of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile
The XLogP value of 4.45138 indicates that 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile. Following Lipinski's Rule of Five, 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile has 0 hydrogen bond donor(s) and 4 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-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile?
The CAS number of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile is 339107-08-3.
What is the molecular formula of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile?
The molecular formula of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile is C20H13N3O3.
What is the molecular weight of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile?
The molecular weight of 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile is 343.10 g/mol.
Where can I buy 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile?
You can request a quote for 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Nitrobenzyl)oxy]pyrido[1,2-a]indole-10-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.