![2-[(2-Nitrophenyl)amino]-3-cyanothiophene structure](/static/products/1867/186792-85-8.webp)
2-[(2-Nitrophenyl)amino]-3-cyanothiophene
TL;DR: 2-[(2-Nitrophenyl)amino]-3-cyanothiophene (CAS 186792-85-8) is a chemical compound with molecular formula C11H7N3O2S and molecular weight 245.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitroanilino)thiophene-3-carbonitrile
Also Known As: 2-[(2-Nitrophenyl)amino]-3-cyanothiophene, 2-(2-nitroanilino)thiophene-3-carbonitrile, 2-[(2-Nitrophenyl)amino]-3-thiophenecarbonitrile, NCI60_035883, 3-Thiophenecarbonitrile, 2-[(2-nitrophenyl)amino]-
| Molecular Formula | C11H7N3O2S |
|---|---|
| Molecular Weight | 245.03 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.0259 |
| Heavy Atoms | 17 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 186792-85-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2=C(C=CS2)C#N)[N+](=O)[O-] |
| InChIKey | BGBMKHNXWAGHQD-UHFFFAOYSA-N |
Product Overview
2-[(2-Nitrophenyl)amino]-3-cyanothiophene (CAS 186792-85-8), with molecular formula C11H7N3O2S and molecular weight 245.03 g/mol. IUPAC: 2-(2-nitroanilino)thiophene-3-carbonitrile.
Chemical Property Profile of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene
Property Insights of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene
The XLogP value of 3.6 indicates that 2-[(2-Nitrophenyl)amino]-3-cyanothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Nitrophenyl)amino]-3-cyanothiophene. Following Lipinski's Rule of Five, 2-[(2-Nitrophenyl)amino]-3-cyanothiophene has 1 hydrogen bond donor(s) and 5 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-[(2-Nitrophenyl)amino]-3-cyanothiophene?
The CAS number of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene is 186792-85-8.
What is the molecular formula of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene?
The molecular formula of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene is C11H7N3O2S.
What is the molecular weight of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene?
The molecular weight of 2-[(2-Nitrophenyl)amino]-3-cyanothiophene is 245.03 g/mol.
Where can I buy 2-[(2-Nitrophenyl)amino]-3-cyanothiophene?
You can request a quote for 2-[(2-Nitrophenyl)amino]-3-cyanothiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Nitrophenyl)amino]-3-cyanothiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Nitrophenyl)amino]-3-cyanothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.