4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile
TL;DR: 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile (CAS 328262-53-9) is a chemical compound with molecular formula C18H12ClN3OS and molecular weight 353.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-2-anilino-5-(4-chlorobenzoyl)thiophene-3-carbonitrile
Also Known As: Bionet1_003333, 4-amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile, 4-amino-5-(4-chlorobenzoyl)-2-(phenylamino)thiophene-3-carbonitrile, 4-amino-2-anilino-5-(4-chlorobenzoyl)thiophene-3-carbonitrile, 2M-933
| Molecular Formula | C18H12ClN3OS |
|---|---|
| Molecular Weight | 353.04 g/mol |
| LogP | 4.82998 |
| Topological Polar Surface Area | 78.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.03897 |
| Heavy Atoms | 24 |
| Complexity | 927.3929 |
Chemical Identifiers
| CAS Number | 328262-53-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)C3=CC=C(C=C3)Cl)N)C#N |
Product Overview
4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile (CAS 328262-53-9), with molecular formula C18H12ClN3OS and molecular weight 353.04 g/mol. IUPAC: 4-amino-2-anilino-5-(4-chlorobenzoyl)thiophene-3-carbonitrile.
Chemical Property Profile of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile
Property Insights of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile
The XLogP value of 4.82998 indicates that 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile. Following Lipinski's Rule of Five, 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile has 2 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 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile?
The CAS number of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile is 328262-53-9.
What is the molecular formula of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile?
The molecular formula of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile is C18H12ClN3OS.
What is the molecular weight of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile?
The molecular weight of 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile is 353.04 g/mol.
Where can I buy 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile?
You can request a quote for 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2-anilino-5-(4-chlorobenzoyl)-3-thiophenecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.