NXN 188
TL;DR: NXN 188 (CAS 75829-97-9) is a chemical compound with molecular formula C27H36N2O6 and molecular weight 484.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-bis[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]pentanoic acid
Also Known As: NXN 188, 4,4-bis[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]pentanoic acid, Benzenebutanoic acid, 4-hydroxy-g-[4-hydroxy-3-(4-morpholinylmethyl)phenyl]-g-methyl-3-(4-morpholinylmethyl)-, 4-benzyl-5-thioxo-4,5-dihydro-3h-1,2,4-triazol-3-one, 4,4-bis[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]pentanoic a
| Molecular Formula | C27H36N2O6 |
|---|---|
| Molecular Weight | 484.26 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 484.25732 |
| Heavy Atoms | 35 |
| Complexity | 622.0 |
Chemical Identifiers
| CAS Number | 75829-97-9 |
|---|---|
| SMILES | CC(CCC(=O)O)(C1=CC(=C(C=C1)O)CN2CCOCC2)C3=CC(=C(C=C3)O)CN4CCOCC4 |
| InChIKey | JWNUBAIGCVTLMJ-UHFFFAOYSA-N |
Product Overview
NXN 188 (CAS 75829-97-9), with molecular formula C27H36N2O6 and molecular weight 484.26 g/mol. IUPAC: 4,4-bis[4-hydroxy-3-(morpholin-4-ylmethyl)phenyl]pentanoic acid.
Chemical Property Profile of NXN 188
Property Insights of NXN 188
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NXN 188. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NXN 188. Following Lipinski's Rule of Five, NXN 188 has 3 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 NXN 188?
The CAS number of NXN 188 is 75829-97-9.
What is the molecular formula of NXN 188?
The molecular formula of NXN 188 is C27H36N2O6.
What is the molecular weight of NXN 188?
The molecular weight of NXN 188 is 484.26 g/mol.
Where can I buy NXN 188?
You can request a quote for NXN 188 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NXN 188?
Yes, KEHONG BIO provides custom synthesis services for NXN 188 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.