2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile
TL;DR: 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile (CAS 302904-33-2) is a chemical compound with molecular formula C16H10Cl2N2OS and molecular weight 347.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-chlorophenyl)-3-(5-chlorothiophen-2-yl)-3-oxopropyl]propanedinitrile
Also Known As: 2-(1-(4-CHLOROPHENYL)-3-(5-CHLORO-2-THIENYL)-3-OXOPROPYL)MALONONITRILE, 2-[1-(4-chlorophenyl)-3-(5-chlorothiophen-2-yl)-3-oxo-propyl]propanedinitrile, 2-[1-(4-chlorophenyl)-3-(5-chlorothiophen-2-yl)-3-oxopropyl]propanedinitrile, 663-795-9, RefChem:450717
| Molecular Formula | C16H10Cl2N2OS |
|---|---|
| Molecular Weight | 347.99 g/mol |
| LogP | 5.07486 |
| Topological Polar Surface Area | 64.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.98907 |
| Heavy Atoms | 22 |
| Complexity | 741.68835 |
Chemical Identifiers
| CAS Number | 302904-33-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(CC(=O)C2=CC=C(S2)Cl)C(C#N)C#N)Cl |
Product Overview
2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile (CAS 302904-33-2), with molecular formula C16H10Cl2N2OS and molecular weight 347.99 g/mol. IUPAC: 2-[1-(4-chlorophenyl)-3-(5-chlorothiophen-2-yl)-3-oxopropyl]propanedinitrile.
Chemical Property Profile of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile
Property Insights of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile
The XLogP value of 5.07486 indicates that 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile. Following Lipinski's Rule of Five, 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile?
The CAS number of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile is 302904-33-2.
What is the molecular formula of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile?
The molecular formula of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile is C16H10Cl2N2OS.
What is the molecular weight of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile?
The molecular weight of 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile is 347.99 g/mol.
Where can I buy 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile?
You can request a quote for 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-(4-Chlorophenyl)-3-(5-chloro-2-thienyl)-3-oxopropyl)malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.