AB00105630-01
TL;DR: AB00105630-01 (CAS 328958-72-1) is a chemical compound with molecular formula C21H17BrN2O4 and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]phenyl]furan-2-carboxamide
Also Known As: AB00105630-01, N-(3-{[(2E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino}phenyl)furan-2-carboxamide, N-[3-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]phenyl]furan-2-carboxamide, N-[3-[3-(5-bromo-2-methoxy-phenyl)prop-2-enoylamino]phenyl]furan-2-carboxamide, 2-Naphthalenesulfonic acid, 5-[[4-(acetylamino)-2-sulfophenyl] azo]-6-amino-4-hydroxy-, disodium salt
| Molecular Formula | C21H17BrN2O4 |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 4.9549 |
| Topological Polar Surface Area | 80.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.03717 |
| Heavy Atoms | 28 |
| Complexity | 1013.0049 |
Chemical Identifiers
| CAS Number | 328958-72-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC(=CC=C2)NC(=O)C3=CC=CO3 |
Product Overview
AB00105630-01 (CAS 328958-72-1), with molecular formula C21H17BrN2O4 and molecular weight 440.04 g/mol. IUPAC: N-[3-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]phenyl]furan-2-carboxamide.
Chemical Property Profile of AB00105630-01
Property Insights of AB00105630-01
The XLogP value of 4.9549 indicates that AB00105630-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.57 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00105630-01. Following Lipinski's Rule of Five, AB00105630-01 has 2 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 AB00105630-01?
The CAS number of AB00105630-01 is 328958-72-1.
What is the molecular formula of AB00105630-01?
The molecular formula of AB00105630-01 is C21H17BrN2O4.
What is the molecular weight of AB00105630-01?
The molecular weight of AB00105630-01 is 440.04 g/mol.
Where can I buy AB00105630-01?
You can request a quote for AB00105630-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00105630-01?
Yes, KEHONG BIO provides custom synthesis services for AB00105630-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.