NCI60_029382
TL;DR: NCI60_029382 (CAS 1033780-52-7) is a chemical compound with molecular formula C34H48N4+2 and molecular weight 512.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[10-[4-(dimethylamino)-2-methylquinolin-1-ium-1-yl]decyl]-N,N,2-trimethylquinolin-1-ium-4-amine
Also Known As: NCI60_029382, 1,1'-(Decane-1,10-diyl)bis[4-(dimethylamino)-2-methylquinolin-1-ium], Quinolinium, 1,1'-(1,10-decanediyl)bis[4-(dimethylamino)-2-methyl-, Quinolinium, 1,1a(2)-(1,10-decanediyl)bis[4-(dimethylamino)-2-methyl-, 1-[10-[4-(dimethylamino)-2-methylquinolin-1-ium-1-yl]decyl]-N,N,2-trimethylquinolin-1-ium-4-amine
| Molecular Formula | C34H48N4+2 |
|---|---|
| Molecular Weight | 512.39 g/mol |
| LogP | 8.9 |
| Topological Polar Surface Area | 14.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 512.3879 |
| Heavy Atoms | 38 |
| Complexity | 609.0 |
Chemical Identifiers
| CAS Number | 1033780-52-7 |
|---|---|
| SMILES | CC1=[N+](C2=CC=CC=C2C(=C1)N(C)C)CCCCCCCCCC[N+]3=C(C=C(C4=CC=CC=C43)N(C)C)C |
| InChIKey | AXNIGYUTTGLXPH-UHFFFAOYSA-N |
Product Overview
NCI60_029382 (CAS 1033780-52-7), with molecular formula C34H48N4+2 and molecular weight 512.39 g/mol. IUPAC: 1-[10-[4-(dimethylamino)-2-methylquinolin-1-ium-1-yl]decyl]-N,N,2-trimethylquinolin-1-ium-4-amine.
Chemical Property Profile of NCI60_029382
Property Insights of NCI60_029382
The XLogP value of 8.9 indicates that NCI60_029382 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 14.2 Ų, NCI60_029382 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, NCI60_029382 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCI60_029382?
The CAS number of NCI60_029382 is 1033780-52-7.
What is the molecular formula of NCI60_029382?
The molecular formula of NCI60_029382 is C34H48N4+2.
What is the molecular weight of NCI60_029382?
The molecular weight of NCI60_029382 is 512.39 g/mol.
Where can I buy NCI60_029382?
You can request a quote for NCI60_029382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_029382?
Yes, KEHONG BIO provides custom synthesis services for NCI60_029382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.