YM 218
TL;DR: YM 218 (CAS 425375-94-6) is a chemical compound with molecular formula C35H38F2N4O4 and molecular weight 616.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(5Z)-4,4-difluoro-5-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethylidene]-2,3-dihydro-1-benzazepine-1-carbonyl]phenyl]-2-methylfuran-3-carboxamide
Also Known As: YM 218, YM218 (free base), YM218, SID:497612853, J1.647.980B
| Molecular Formula | C35H38F2N4O4 |
|---|---|
| Molecular Weight | 616.29 g/mol |
| LogP | 6.38642 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 616.28613 |
| Heavy Atoms | 45 |
| Complexity | 1584.8156 |
Chemical Identifiers
| CAS Number | 425375-94-6 |
|---|---|
| SMILES | CC1=C(C=CO1)C(=O)NC2=CC=C(C=C2)C(=O)N3CCC(/C(=C\C(=O)N4CCC(CC4)N5CCCCC5)/C6=CC=CC=C63)(F)F |
Product Overview
YM 218 (CAS 425375-94-6), with molecular formula C35H38F2N4O4 and molecular weight 616.29 g/mol. IUPAC: N-[4-[(5Z)-4,4-difluoro-5-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethylidene]-2,3-dihydro-1-benzazepine-1-carbonyl]phenyl]-2-methylfuran-3-carboxamide.
Chemical Property Profile of YM 218
Property Insights of YM 218
The XLogP value of 6.38642 indicates that YM 218 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for YM 218. Following Lipinski's Rule of Five, YM 218 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of YM 218?
The CAS number of YM 218 is 425375-94-6.
What is the molecular formula of YM 218?
The molecular formula of YM 218 is C35H38F2N4O4.
What is the molecular weight of YM 218?
The molecular weight of YM 218 is 616.29 g/mol.
Where can I buy YM 218?
You can request a quote for YM 218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for YM 218?
Yes, KEHONG BIO provides custom synthesis services for YM 218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.