A3062/0129407
TL;DR: A3062/0129407 (CAS 380476-35-7) is a chemical compound with molecular formula C25H18Cl2N2O4 and molecular weight 480.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-cyano-3-(3,5-dichloroanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methylbenzoate
Also Known As: A3062/0129407, [4-[(E)-2-cyano-3-(3,5-dichloroanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methylbenzoate, 4-{(1E)-2-cyano-3-[(3,5-dichlorophenyl)amino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl 4-methylbenzoate, 4-[(E)-2-CYANO-3-(3,5-DICHLOROANILINO)-3-OXO-1-PROPENYL]-2-METHOXYPHENYL 4-METHYLBENZOATE, 4-{2-cyano-2-[(3,5-dichlorophenyl)carbamoyl]eth-1-en-1-yl}-2-methoxyphenyl 4-methylbenzoate
| Molecular Formula | C25H18Cl2N2O4 |
|---|---|
| Molecular Weight | 480.06 g/mol |
| LogP | 6.0753 |
| Topological Polar Surface Area | 88.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.06436 |
| Heavy Atoms | 33 |
| Complexity | 1258.3047 |
Chemical Identifiers
| CAS Number | 380476-35-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)NC3=CC(=CC(=C3)Cl)Cl)OC |
Product Overview
A3062/0129407 (CAS 380476-35-7), with molecular formula C25H18Cl2N2O4 and molecular weight 480.06 g/mol. IUPAC: [4-[(E)-2-cyano-3-(3,5-dichloroanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methylbenzoate.
Chemical Property Profile of A3062/0129407
Property Insights of A3062/0129407
The XLogP value of 6.0753 indicates that A3062/0129407 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.42 Ų falls within the moderate polarity range, balancing permeability and solubility for A3062/0129407. Following Lipinski's Rule of Five, A3062/0129407 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3062/0129407?
The CAS number of A3062/0129407 is 380476-35-7.
What is the molecular formula of A3062/0129407?
The molecular formula of A3062/0129407 is C25H18Cl2N2O4.
What is the molecular weight of A3062/0129407?
The molecular weight of A3062/0129407 is 480.06 g/mol.
Where can I buy A3062/0129407?
You can request a quote for A3062/0129407 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3062/0129407?
Yes, KEHONG BIO provides custom synthesis services for A3062/0129407 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.