YM 17690
TL;DR: YM 17690 (CAS 108806-41-3) is a chemical compound with molecular formula C28H29NO7 and molecular weight 491.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(carboxymethoxy)-3-[[4-(4-phenylbutoxy)benzoyl]amino]phenyl]propanoic acid
Also Known As: 3-(4-Carboxymethoxy-3-(4-(4-phenylbutoxy)benzamido)phenyl)propionic acid, YM17690;YM-17690, Benzenepropanoic acid, 4-(carboxymethoxy)-3-((4-(4-phenylbutoxy)benzoyl)amino)-, 3-[4-(carboxymethoxy)-3-[[4-(4-phenylbutoxy)benzoyl]amino]phenyl]propanoic acid, 3-(4-(carboxymethoxy)-3-(4-(4-phenylbutoxy)benzamido)phenyl)propanoic acid
| Molecular Formula | C28H29NO7 |
|---|---|
| Molecular Weight | 491.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 491.1944 |
| Heavy Atoms | 36 |
| Complexity | 685.0 |
Chemical Identifiers
| CAS Number | 108806-41-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)CCC(=O)O)OCC(=O)O |
| InChIKey | UXHPYKYCGVQOFX-UHFFFAOYSA-N |
Product Overview
YM 17690 (CAS 108806-41-3), with molecular formula C28H29NO7 and molecular weight 491.19 g/mol. IUPAC: 3-[4-(carboxymethoxy)-3-[[4-(4-phenylbutoxy)benzoyl]amino]phenyl]propanoic acid.
Chemical Property Profile of YM 17690
Property Insights of YM 17690
The XLogP value of 4.7 indicates that YM 17690 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for YM 17690. Following Lipinski's Rule of Five, YM 17690 has 3 hydrogen bond donor(s) and 7 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 YM 17690?
The CAS number of YM 17690 is 108806-41-3.
What is the molecular formula of YM 17690?
The molecular formula of YM 17690 is C28H29NO7.
What is the molecular weight of YM 17690?
The molecular weight of YM 17690 is 491.19 g/mol.
Where can I buy YM 17690?
You can request a quote for YM 17690 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for YM 17690?
Yes, KEHONG BIO provides custom synthesis services for YM 17690 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.