![3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile structure](/static/products/172/172541-56-9.png)
3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile
TL;DR: 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile (CAS 172541-56-9) is a chemical compound with molecular formula C16H11N3O and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-4,5,6,11-tetrahydropyrido[3,2-a]carbazole-2-carbonitrile
Also Known As: 3-oxo-4,5,6,11-tetrahydropyrido[3,2-a]carbazole-2-carbonitrile, 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile
| Molecular Formula | C16H11N3O |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 2.49348 |
| Topological Polar Surface Area | 72.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 261.0902 |
| Heavy Atoms | 20 |
| Complexity | 940.4909 |
Chemical Identifiers
| CAS Number | 172541-56-9 |
|---|---|
| SMILES | C1CC2=C(C=C(C(=O)N2)C#N)C3=C1C4=CC=CC=C4N3 |
Product Overview
3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile (CAS 172541-56-9), with molecular formula C16H11N3O and molecular weight 261.09 g/mol. IUPAC: 3-oxo-4,5,6,11-tetrahydropyrido[3,2-a]carbazole-2-carbonitrile.
Chemical Property Profile of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile
Property Insights of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile
The XLogP value of 2.49348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile. The TPSA of 72.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile. Following Lipinski's Rule of Five, 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile has 2 hydrogen bond donor(s) and 2 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-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile?
The CAS number of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile is 172541-56-9.
What is the molecular formula of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile?
The molecular formula of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile is C16H11N3O.
What is the molecular weight of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile?
The molecular weight of 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile is 261.09 g/mol.
Where can I buy 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile?
You can request a quote for 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-oxo-4,5,6,11-tetrahydro-3H-pyrido[3,2-a]carbazole-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.