![Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate structure](/static/products/3518/351892-49-4.webp)
Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate
TL;DR: Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate (CAS 351892-49-4) is a chemical compound with molecular formula C15H18ClNO5 and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[(3-chloro-4-methoxyanilino)methylidene]propanedioate
Also Known As: BIM-0045162.P001, DIETHYL 2-[[(3-CHLORO-4-METHOXY-PHENYL)AMINO]METHYLIDENE]PROPANEDIOATE, diethyl 2-[(3-chloro-4-methoxyanilino)methylidene]propanedioate, F6782-3865, diethyl {[(3-chloro-4-methoxyphenyl)amino]methylidene}propanedioate
| Molecular Formula | C15H18ClNO5 |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 2.7706 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 327.08734 |
| Heavy Atoms | 22 |
| Complexity | 551.0513 |
Chemical Identifiers
| CAS Number | 351892-49-4 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC(=C(C=C1)OC)Cl)C(=O)OCC |
Product Overview
Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate (CAS 351892-49-4), with molecular formula C15H18ClNO5 and molecular weight 327.09 g/mol. IUPAC: diethyl 2-[(3-chloro-4-methoxyanilino)methylidene]propanedioate.
Chemical Property Profile of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate
Property Insights of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate
The XLogP value of 2.7706 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate. Following Lipinski's Rule of Five, Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate has 1 hydrogen bond donor(s) and 6 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 Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate?
The CAS number of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate is 351892-49-4.
What is the molecular formula of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate?
The molecular formula of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate is C15H18ClNO5.
What is the molecular weight of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate?
The molecular weight of Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate is 327.09 g/mol.
Where can I buy Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate?
You can request a quote for Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-[[(3-chloro-4-methoxy-phenyl)amino]methylidene]propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.