RefChem:1066954
TL;DR: RefChem:1066954 (CAS 4035-43-2) is a chemical compound with molecular formula C21H26ClN and molecular weight 327.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propan-1-amine;hydrochloride
Also Known As: 11-(3-(Dimethylamino)propyl)-9,10-dihydro-9,10-ethanoanthracene hydrochloride, 9,10-Dihydro-11-(3-(dimethylamino)propyl)-9,10-ethanoanthracene hydrochloride, 9,10-Ethanoanthracene, 9,10-dihydro-11-(3-(dimethylamino)propyl)-, hydrochloride, 3-(9,10-Dihydro-9,10-ethanoanthracen-11-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1), 9,10-Ethanoanthracene-11-propylamine, 9,10-dihydro-N,N-dimethyl-, hydrochloride
| Molecular Formula | C21H26ClN |
|---|---|
| Molecular Weight | 327.18 g/mol |
| LogP | 5.0473 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.17538 |
| Heavy Atoms | 23 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 4035-43-2 |
|---|---|
| SMILES | CN(C)CCCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24.Cl |
| InChIKey | INFCXZVLPISHBT-UHFFFAOYSA-N |
Product Overview
RefChem:1066954 (CAS 4035-43-2), with molecular formula C21H26ClN and molecular weight 327.18 g/mol. IUPAC: N,N-dimethyl-3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propan-1-amine;hydrochloride.
Chemical Property Profile of RefChem:1066954
Property Insights of RefChem:1066954
The XLogP value of 5.0473 indicates that RefChem:1066954 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, RefChem:1066954 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1066954 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1066954?
The CAS number of RefChem:1066954 is 4035-43-2.
What is the molecular formula of RefChem:1066954?
The molecular formula of RefChem:1066954 is C21H26ClN.
What is the molecular weight of RefChem:1066954?
The molecular weight of RefChem:1066954 is 327.18 g/mol.
Where can I buy RefChem:1066954?
You can request a quote for RefChem:1066954 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066954?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066954 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.