YM466 free base
TL;DR: YM466 free base (CAS 201933-41-7) is a chemical compound with molecular formula C27H31N5O5S and molecular weight 537.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-carbamimidoylnaphthalen-2-yl)methyl-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]sulfamoyl]acetic acid
Also Known As: YM466 free base, YM 60828, YM-466 free base, YM75466 free base, YM-75466 free base
| Molecular Formula | C27H31N5O5S |
|---|---|
| Molecular Weight | 537.20 g/mol |
| LogP | 3.38524 |
| Topological Polar Surface Area | 160.87 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 537.2046 |
| Heavy Atoms | 38 |
| Complexity | 1464.9615 |
Chemical Identifiers
| CAS Number | 201933-41-7 |
|---|---|
| SMILES | CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)N(CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N)S(=O)(=O)CC(=O)O |
Product Overview
YM466 free base (CAS 201933-41-7), with molecular formula C27H31N5O5S and molecular weight 537.20 g/mol. IUPAC: 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]sulfamoyl]acetic acid.
Chemical Property Profile of YM466 free base
Property Insights of YM466 free base
The XLogP value of 3.38524 indicates that YM466 free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 160.87 Ų indicates high polarity, suggesting YM466 free base may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, YM466 free base has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of YM466 free base?
The CAS number of YM466 free base is 201933-41-7.
What is the molecular formula of YM466 free base?
The molecular formula of YM466 free base is C27H31N5O5S.
What is the molecular weight of YM466 free base?
The molecular weight of YM466 free base is 537.20 g/mol.
Where can I buy YM466 free base?
You can request a quote for YM466 free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for YM466 free base?
Yes, KEHONG BIO provides custom synthesis services for YM466 free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.