AB00093125-01
TL;DR: AB00093125-01 (CAS 470472-03-8) is a chemical compound with molecular formula C17H14Br2N2O5 and molecular weight 483.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(Z)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic acid
Also Known As: AB00093125-01, n-[2-[(5-bromo-2-furoyl)amino]-3-(4-bromophenyl)acryloyl]alanine, 2-[[(Z)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic acid, 2-[[2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic Acid
| Molecular Formula | C17H14Br2N2O5 |
|---|---|
| Molecular Weight | 483.93 g/mol |
| LogP | 3.1648 |
| Topological Polar Surface Area | 108.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.92694 |
| Heavy Atoms | 26 |
| Complexity | 858.2931 |
Chemical Identifiers
| CAS Number | 470472-03-8 |
|---|---|
| SMILES | CC(C(=O)O)NC(=O)/C(=C/C1=CC=C(C=C1)Br)/NC(=O)C2=CC=C(O2)Br |
Product Overview
AB00093125-01 (CAS 470472-03-8), with molecular formula C17H14Br2N2O5 and molecular weight 483.93 g/mol. IUPAC: 2-[[(Z)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-bromophenyl)prop-2-enoyl]amino]propanoic acid.
Chemical Property Profile of AB00093125-01
Property Insights of AB00093125-01
The XLogP value of 3.1648 indicates that AB00093125-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00093125-01. Following Lipinski's Rule of Five, AB00093125-01 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 AB00093125-01?
The CAS number of AB00093125-01 is 470472-03-8.
What is the molecular formula of AB00093125-01?
The molecular formula of AB00093125-01 is C17H14Br2N2O5.
What is the molecular weight of AB00093125-01?
The molecular weight of AB00093125-01 is 483.93 g/mol.
Where can I buy AB00093125-01?
You can request a quote for AB00093125-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00093125-01?
Yes, KEHONG BIO provides custom synthesis services for AB00093125-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.