RefChem:248677
TL;DR: RefChem:248677 (CAS 981-41-9) is a chemical compound with molecular formula C23H30Cl4N2 and molecular weight 474.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-1-[3-[[(2-chlorophenyl)methylamino]methyl]spiro[3.3]heptan-7-yl]methanamine;dihydrochloride
Also Known As: N,N'-Bis(2-chlorobenzyl)-2,6-spiro(3.3)heptanebis(methylamine) dihydrochloride, 2,6-Spiro(3.3)heptanebis(methylamine), N,N'-bis(2-chlorobenzyl)-, dihydrochloride, Benzylamine, N,N'-(2,6-spiro(3.3)heptylenedimethylene)bis(2-chloro-, dihydrochloride, N,N'-(2,6-Spiro(3.3)heptylenedimethylene)bis(2-chlorobenzylamine) dihydrochloride, spiro[3.3]heptane-1,5-diylbis[n-(2-chlorobenzyl)methanamine] dihydrochloride
| Molecular Formula | C23H30Cl4N2 |
|---|---|
| Molecular Weight | 474.12 g/mol |
| LogP | 6.52 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.11337 |
| Heavy Atoms | 29 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 981-41-9 |
|---|---|
| SMILES | C1CC2(C1CNCC3=CC=CC=C3Cl)CCC2CNCC4=CC=CC=C4Cl.Cl.Cl |
| InChIKey | UBGHFEFTDIQMFK-UHFFFAOYSA-N |
Product Overview
RefChem:248677 (CAS 981-41-9), with molecular formula C23H30Cl4N2 and molecular weight 474.12 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-1-[3-[[(2-chlorophenyl)methylamino]methyl]spiro[3.3]heptan-7-yl]methanamine;dihydrochloride.
Chemical Property Profile of RefChem:248677
Property Insights of RefChem:248677
The XLogP value of 6.52 indicates that RefChem:248677 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, RefChem:248677 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:248677 has 4 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 RefChem:248677?
The CAS number of RefChem:248677 is 981-41-9.
What is the molecular formula of RefChem:248677?
The molecular formula of RefChem:248677 is C23H30Cl4N2.
What is the molecular weight of RefChem:248677?
The molecular weight of RefChem:248677 is 474.12 g/mol.
Where can I buy RefChem:248677?
You can request a quote for RefChem:248677 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:248677?
Yes, KEHONG BIO provides custom synthesis services for RefChem:248677 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.