AB01332357-02
TL;DR: AB01332357-02 (CAS 445465-08-7) is a chemical compound with molecular formula C14H10F5N3O2 and molecular weight 347.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(3,5-dimethoxyanilino)-2,2,3,3,3-pentafluoropropylidene]propanedinitrile
Also Known As: AB01332357-02, A2742/0116482, 2-[1-(3,5-Dimethoxy-phenylamino)-2,2,3,3,3-pentafluoro-propylidene]-malononitrile, 2-[1-(3,5-Dimethoxyanilino)-perfluoropropylidene]propanedinitrile, {1-[(3,5-dimethoxyphenyl)amino]-2,2,3,3,3-pentafluoropropylidene}propanedinitrile
| Molecular Formula | C14H10F5N3O2 |
|---|---|
| Molecular Weight | 347.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.0693 |
| Heavy Atoms | 24 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 445465-08-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)NC(=C(C#N)C#N)C(C(F)(F)F)(F)F)OC |
| InChIKey | KXLHJDIQPNVRPL-UHFFFAOYSA-N |
Product Overview
AB01332357-02 (CAS 445465-08-7), with molecular formula C14H10F5N3O2 and molecular weight 347.07 g/mol. IUPAC: 2-[1-(3,5-dimethoxyanilino)-2,2,3,3,3-pentafluoropropylidene]propanedinitrile.
Chemical Property Profile of AB01332357-02
Property Insights of AB01332357-02
The XLogP value of 3.8 indicates that AB01332357-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01332357-02. Following Lipinski's Rule of Five, AB01332357-02 has 1 hydrogen bond donor(s) and 10 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 AB01332357-02?
The CAS number of AB01332357-02 is 445465-08-7.
What is the molecular formula of AB01332357-02?
The molecular formula of AB01332357-02 is C14H10F5N3O2.
What is the molecular weight of AB01332357-02?
The molecular weight of AB01332357-02 is 347.07 g/mol.
Where can I buy AB01332357-02?
You can request a quote for AB01332357-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01332357-02?
Yes, KEHONG BIO provides custom synthesis services for AB01332357-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.