(E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid
TL;DR: (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid (CAS 332106-25-9) is a chemical compound with molecular formula C19H17BrN2O4 and molecular weight 416.04 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-phenylprop-2-enoyl]amino]propanoic acid
Also Known As: BAS 01123280, (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid, 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoyl]amino]propanoic acid, N-[(2E)-2-{[(4-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]-beta-alanine
| Molecular Formula | C19H17BrN2O4 |
|---|---|
| Molecular Weight | 416.04 g/mol |
| LogP | 2.8109 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.03717 |
| Heavy Atoms | 26 |
| Complexity | 817.19257 |
Chemical Identifiers
| CAS Number | 332106-25-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C(\C(=O)NCCC(=O)O)/NC(=O)C2=CC=C(C=C2)Br |
Product Overview
(E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid (CAS 332106-25-9), with molecular formula C19H17BrN2O4 and molecular weight 416.04 g/mol. IUPAC: 3-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoyl]amino]propanoic acid.
Chemical Property Profile of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid
Property Insights of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid
The XLogP value of 2.8109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid. Following Lipinski's Rule of Five, (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid has 3 hydrogen bond donor(s) and 3 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 (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid?
The CAS number of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid is 332106-25-9.
What is the molecular formula of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid?
The molecular formula of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid is C19H17BrN2O4.
What is the molecular weight of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid?
The molecular weight of (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid is 416.04 g/mol.
Where can I buy (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid?
You can request a quote for (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(2-(4-bromobenzamido)-3-phenylacrylamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.