![3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid structure](/static/products/3545/354549-69-2.webp)
3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid
TL;DR: 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid (CAS 354549-69-2) is a chemical compound with molecular formula C24H19BrN2O5 and molecular weight 494.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(E)-2-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid
Also Known As: AL-281/14557051, 3-{[2-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid, 3-[(2E)-2-[(4-BROMOPHENYL)FORMAMIDO]-3-(4-METHOXYPHENYL)PROP-2-ENAMIDO]BENZOIC ACID, 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid, (E)-3-(2-(4-bromobenzamido)-3-(4-methoxyphenyl)acrylamido)benzoic acid
| Molecular Formula | C24H19BrN2O5 |
|---|---|
| Molecular Weight | 494.05 g/mol |
| LogP | 4.5655 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.04773 |
| Heavy Atoms | 32 |
| Complexity | 1171.7538 |
Chemical Identifiers
| CAS Number | 354549-69-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C(\C(=O)NC2=CC=CC(=C2)C(=O)O)/NC(=O)C3=CC=C(C=C3)Br |
Product Overview
3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid (CAS 354549-69-2), with molecular formula C24H19BrN2O5 and molecular weight 494.05 g/mol. IUPAC: 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid.
Chemical Property Profile of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid
Property Insights of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid
The XLogP value of 4.5655 indicates that 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid. Following Lipinski's Rule of Five, 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid has 3 hydrogen bond donor(s) and 4 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 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid?
The CAS number of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid is 354549-69-2.
What is the molecular formula of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid?
The molecular formula of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid is C24H19BrN2O5.
What is the molecular weight of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid?
The molecular weight of 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid is 494.05 g/mol.
Where can I buy 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid?
You can request a quote for 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[2-[(4-Bromobenzoyl)amino]-3-(4-methoxyphenyl)acryloyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.