BAS 00550421
TL;DR: BAS 00550421 (CAS 325826-17-3) is a chemical compound with molecular formula C23H20N4O6 and molecular weight 448.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[(E)-[[2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]oxy]acetyl]hydrazinylidene]methyl]furan-2-yl]benzoic acid
Also Known As: BAS 00550421, (E)-4-(5-((2-(2-((3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl)oxy)acetyl)hydrazono)methyl)furan-2-yl)benzoic acid, 4-(5-{(E)-[2-({[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}acetyl)hydrazinylidene]methyl}furan-2-yl)benzoic acid, 4-[5-[(E)-[[2-[3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxyacetyl]hydrazinylidene]methyl]furan-2-yl]benzoic acid, 4-{5-[(E)-[(2-{[3-CYANO-4-(METHOXYMETHYL)-6-METHYLPYRIDIN-2-YL]OXY}ACETAMIDO)IMINO]METHYL]FURAN-2-YL}BENZOIC ACID
| Molecular Formula | C23H20N4O6 |
|---|---|
| Molecular Weight | 448.14 g/mol |
| LogP | 2.8954 |
| Topological Polar Surface Area | 147.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 448.13828 |
| Heavy Atoms | 33 |
| Complexity | 1224.7389 |
Chemical Identifiers
| CAS Number | 325826-17-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)OCC(=O)N/N=C/C2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)C#N)COC |
Product Overview
BAS 00550421 (CAS 325826-17-3), with molecular formula C23H20N4O6 and molecular weight 448.14 g/mol. IUPAC: 4-[5-[(E)-[[2-[[3-cyano-4-(methoxymethyl)-6-methyl-2-pyridinyl]oxy]acetyl]hydrazinylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of BAS 00550421
Property Insights of BAS 00550421
The XLogP value of 2.8954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00550421. The TPSA of 147.04 Ų indicates high polarity, suggesting BAS 00550421 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00550421 has 2 hydrogen bond donor(s) and 8 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 00550421?
The CAS number of BAS 00550421 is 325826-17-3.
What is the molecular formula of BAS 00550421?
The molecular formula of BAS 00550421 is C23H20N4O6.
What is the molecular weight of BAS 00550421?
The molecular weight of BAS 00550421 is 448.14 g/mol.
Where can I buy BAS 00550421?
You can request a quote for BAS 00550421 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00550421?
Yes, KEHONG BIO provides custom synthesis services for BAS 00550421 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.