Ba 138/111
TL;DR: Ba 138/111 (CAS 32862-59-2) is a chemical compound with molecular formula C22H35N3O3 and molecular weight 389.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,1-N-diethyl-4-N-(4,5,8-trimethoxy-2-methylquinolin-6-yl)pentane-1,4-diamine
Also Known As: Ba 138/111, 6-((4-(Diethylamino)-1-methylbutyl)amino)-2-methyl-4,5,8-trimethoxyquinoline, Quinoline, 6-((4-(diethylamino)-1-methylbutyl)amino)-2-methyl-4,5,8-trimethoxy-, 1-N,1-N-diethyl-4-N-(4,5,8-trimethoxy-2-methylquinolin-6-yl)pentane-1,4-diamine, N~1~,N~1~-Diethyl-N~4~-(4,5,8-trimethoxy-2-methylquinolin-6-yl)pentane-1,4-diamine
| Molecular Formula | C22H35N3O3 |
|---|---|
| Molecular Weight | 389.27 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 389.26785 |
| Heavy Atoms | 28 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 32862-59-2 |
|---|---|
| SMILES | CCN(CC)CCCC(C)NC1=C(C2=C(C=C(N=C2C(=C1)OC)C)OC)OC |
| InChIKey | KIQWWLHFEKTYBR-UHFFFAOYSA-N |
Product Overview
Ba 138/111 (CAS 32862-59-2), with molecular formula C22H35N3O3 and molecular weight 389.27 g/mol. IUPAC: 1-N,1-N-diethyl-4-N-(4,5,8-trimethoxy-2-methylquinolin-6-yl)pentane-1,4-diamine.
Chemical Property Profile of Ba 138/111
Property Insights of Ba 138/111
The XLogP value of 4.4 indicates that Ba 138/111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.9 Ų, Ba 138/111 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ba 138/111 has 1 hydrogen bond donor(s) and 6 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 Ba 138/111?
The CAS number of Ba 138/111 is 32862-59-2.
What is the molecular formula of Ba 138/111?
The molecular formula of Ba 138/111 is C22H35N3O3.
What is the molecular weight of Ba 138/111?
The molecular weight of Ba 138/111 is 389.27 g/mol.
Where can I buy Ba 138/111?
You can request a quote for Ba 138/111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ba 138/111?
Yes, KEHONG BIO provides custom synthesis services for Ba 138/111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.