BK 66
TL;DR: BK 66 (CAS 68931-07-7) is a chemical compound with molecular formula C23H36N2O7 and molecular weight 452.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-oxoacetate;3-pyrrolidin-1-ium-1-ylpropyl N-(2-heptoxyphenyl)carbamate
Also Known As: BK 66, 3-(1-Pyrrolidinyl)propyl o-(heptyloxy)carbanilate oxalate (1:1), Carbamic acid, (2-(heptyloxy)phenyl)-, 3-(1-pyrrolidinyl)propyl ester, ethanedioate (1:1), CARBANILIC ACID, o-(HEPTYLOXY)-, 3-(1-PYRROLIDINYL)PROPYL ESTER, OXALATE (1:1), o-(Heptyloxy)carbanilic acid 3-(1-pyrrolidinyl)propyl ester oxalate (1:1)
| Molecular Formula | C23H36N2O7 |
|---|---|
| Molecular Weight | 452.25 g/mol |
| LogP | 1.47 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 452.25226 |
| Heavy Atoms | 32 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 68931-07-7 |
|---|---|
| SMILES | CCCCCCCOC1=CC=CC=C1NC(=O)OCCC[NH+]2CCCC2.C(=O)(C(=O)[O-])O |
| InChIKey | DXKXZCFMTNUGBA-UHFFFAOYSA-N |
Product Overview
BK 66 (CAS 68931-07-7), with molecular formula C23H36N2O7 and molecular weight 452.25 g/mol. IUPAC: 2-hydroxy-2-oxoacetate;3-pyrrolidin-1-ium-1-ylpropyl N-(2-heptoxyphenyl)carbamate.
Chemical Property Profile of BK 66
Property Insights of BK 66
The XLogP value of 1.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BK 66. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BK 66. Following Lipinski's Rule of Five, BK 66 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 BK 66?
The CAS number of BK 66 is 68931-07-7.
What is the molecular formula of BK 66?
The molecular formula of BK 66 is C23H36N2O7.
What is the molecular weight of BK 66?
The molecular weight of BK 66 is 452.25 g/mol.
Where can I buy BK 66?
You can request a quote for BK 66 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BK 66?
Yes, KEHONG BIO provides custom synthesis services for BK 66 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.