RefChem:1052345
TL;DR: RefChem:1052345 (CAS 25517-25-3) is a chemical compound with molecular formula C16H32Cl2N2 and molecular weight 322.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-N',N'-diethylethane-1,2-diamine;dihydrochloride
Also Known As: NIOSH/KV1400000, 1-(N,N-Dietilaminoetilamino)adamantano, 1-(N,N-Dietilaminoetilamino)adamantano [Italian], 1,2-Ethanediamine, N,N-diethyl-N'-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-, dihydrochloride, Dichlorhydrate de diethylaminoethylamino-1 adamantane
| Molecular Formula | C16H32Cl2N2 |
|---|---|
| Molecular Weight | 322.19 g/mol |
| LogP | 3.73 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.19424 |
| Heavy Atoms | 20 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 25517-25-3 |
|---|---|
| SMILES | CCN(CC)CCNC12CC3CC(C1)CC(C3)C2.Cl.Cl |
| InChIKey | LZUXJGCWIJABFK-UHFFFAOYSA-N |
Product Overview
RefChem:1052345 (CAS 25517-25-3), with molecular formula C16H32Cl2N2 and molecular weight 322.19 g/mol. IUPAC: N-(1-adamantyl)-N',N'-diethylethane-1,2-diamine;dihydrochloride.
Chemical Property Profile of RefChem:1052345
Property Insights of RefChem:1052345
The XLogP value of 3.73 indicates that RefChem:1052345 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, RefChem:1052345 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1052345 has 3 hydrogen bond donor(s) and 2 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 RefChem:1052345?
The CAS number of RefChem:1052345 is 25517-25-3.
What is the molecular formula of RefChem:1052345?
The molecular formula of RefChem:1052345 is C16H32Cl2N2.
What is the molecular weight of RefChem:1052345?
The molecular weight of RefChem:1052345 is 322.19 g/mol.
Where can I buy RefChem:1052345?
You can request a quote for RefChem:1052345 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1052345?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1052345 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.