![2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile structure](/static/products/314/314282-89-8.png)
2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
TL;DR: 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile (CAS 314282-89-8) is a chemical compound with molecular formula C14H10N4O4S and molecular weight 330.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dinitroanilino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Also Known As: 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile, 2-(2,4-dinitroanilino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile, 2-[(2,4-dinitrophenyl)amino]-4,5,6-trihydrocyclopenta[2,1-b]thiophene-3-carbon itrile
| Molecular Formula | C14H10N4O4S |
|---|---|
| Molecular Weight | 330.04 g/mol |
| LogP | 3.66848 |
| Topological Polar Surface Area | 122.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.04227 |
| Heavy Atoms | 23 |
| Complexity | 868.3927 |
Chemical Identifiers
| CAS Number | 314282-89-8 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C#N)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile (CAS 314282-89-8), with molecular formula C14H10N4O4S and molecular weight 330.04 g/mol. IUPAC: 2-(2,4-dinitroanilino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile.
Chemical Property Profile of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Property Insights of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
The XLogP value of 3.66848 indicates that 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile. Following Lipinski's Rule of Five, 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile has 1 hydrogen bond donor(s) and 7 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-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile?
The CAS number of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile is 314282-89-8.
What is the molecular formula of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile?
The molecular formula of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile is C14H10N4O4S.
What is the molecular weight of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile?
The molecular weight of 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile is 330.04 g/mol.
Where can I buy 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile?
You can request a quote for 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,4-dinitrophenyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.