RefChem:1066251
TL;DR: RefChem:1066251 (CAS 31429-04-6) is a chemical compound with molecular formula C40H55N3 and molecular weight 577.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[[2-[2-(dimethylamino)ethyl]-4-methyl-2-naphthalen-1-ylpentylidene]amino]methyl]-N,N,5-trimethyl-3-naphthalen-1-ylhexan-1-amine
Also Known As: 1-Naphthalenepropylamine, gamma,gamma'-nitrilodimethylenebis(N,N-dimethyl-gamma-isobutyl-, gamma,gamma'-Nitrilodimethylenebis(N,N-dimethyl-gamma-isobutyl-1-naphthalenepropylamine), 3-[[[2-[2-(dimethylamino)ethyl]-4-methyl-2-naphthalen-1-ylpe, 1,4-Butanediamine, N-(4-(dimethylamino)-2-isobutyl-2-(1-naphthyl)butylidene)-2-isobutyl-N',N'-dimethyl-2-(1-naphthyl)-, n1-[(1e)-2-[2-(dimethylamino)ethyl]-4-methyl-2-(naphthalen-1-yl)pentylidene]-n4,n4-dimethyl-2-(2-methylpropyl)-2-(naphthalen-1-yl)butane-1,4-diamine
| Molecular Formula | C40H55N3 |
|---|---|
| Molecular Weight | 577.44 g/mol |
| LogP | 9.7 |
| Topological Polar Surface Area | 18.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 577.4396 |
| Heavy Atoms | 43 |
| Complexity | 832.0 |
Chemical Identifiers
| CAS Number | 31429-04-6 |
|---|---|
| SMILES | CC(C)CC(CCN(C)C)(CN=CC(CCN(C)C)(CC(C)C)C1=CC=CC2=CC=CC=C21)C3=CC=CC4=CC=CC=C43 |
| InChIKey | CKAFUQZOQFUECR-UHFFFAOYSA-N |
Product Overview
RefChem:1066251 (CAS 31429-04-6), with molecular formula C40H55N3 and molecular weight 577.44 g/mol. IUPAC: 3-[[[2-[2-(dimethylamino)ethyl]-4-methyl-2-naphthalen-1-ylpentylidene]amino]methyl]-N,N,5-trimethyl-3-naphthalen-1-ylhexan-1-amine.
Chemical Property Profile of RefChem:1066251
Property Insights of RefChem:1066251
The XLogP value of 9.7 indicates that RefChem:1066251 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.8 Ų, RefChem:1066251 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1066251 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1066251?
The CAS number of RefChem:1066251 is 31429-04-6.
What is the molecular formula of RefChem:1066251?
The molecular formula of RefChem:1066251 is C40H55N3.
What is the molecular weight of RefChem:1066251?
The molecular weight of RefChem:1066251 is 577.44 g/mol.
Where can I buy RefChem:1066251?
You can request a quote for RefChem:1066251 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066251?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066251 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.