BAS 02717678
TL;DR: BAS 02717678 (CAS 304880-65-7) is a chemical compound with molecular formula C20H19BrN2O4 and molecular weight 430.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]butanoic acid
Also Known As: BAS 02717678, (E)-4-(2-benzamido-3-(4-bromophenyl)acrylamido)butanoic acid, 4-[2-Benzoylamino-3-(4-bromo-phenyl)-acryloylamino]-butyric acid, 4-{[2-(benzoylamino)-3-(4-bromophenyl)acryloyl]amino}butanoic acid, 4-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]butanoic acid
| Molecular Formula | C20H19BrN2O4 |
|---|---|
| Molecular Weight | 430.05 g/mol |
| LogP | 3.201 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.05283 |
| Heavy Atoms | 27 |
| Complexity | 832.82 |
Chemical Identifiers
| CAS Number | 304880-65-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)Br)/C(=O)NCCCC(=O)O |
Product Overview
BAS 02717678 (CAS 304880-65-7), with molecular formula C20H19BrN2O4 and molecular weight 430.05 g/mol. IUPAC: 4-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]butanoic acid.
Chemical Property Profile of BAS 02717678
Property Insights of BAS 02717678
The XLogP value of 3.201 indicates that BAS 02717678 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02717678. Following Lipinski's Rule of Five, BAS 02717678 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 BAS 02717678?
The CAS number of BAS 02717678 is 304880-65-7.
What is the molecular formula of BAS 02717678?
The molecular formula of BAS 02717678 is C20H19BrN2O4.
What is the molecular weight of BAS 02717678?
The molecular weight of BAS 02717678 is 430.05 g/mol.
Where can I buy BAS 02717678?
You can request a quote for BAS 02717678 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02717678?
Yes, KEHONG BIO provides custom synthesis services for BAS 02717678 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.