(2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol
TL;DR: (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol (CAS 119567-63-4) is a chemical compound with molecular formula C20H41NO2 and molecular weight 327.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol
Also Known As: N,N-dimethylsphingosine, KBio2_000140, KBio2_002708, KBio2_005276, KBio3_000279
| Molecular Formula | C20H41NO2 |
|---|---|
| Molecular Weight | 327.31 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 16 |
| Exact Mass | 327.31372 |
| Heavy Atoms | 23 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 119567-63-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCC=C[C@H]([C@H](CO)N(C)C)O |
| InChIKey | YRXOQXUDKDCXME-VQTJNVASSA-N |
Product Overview
(2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol (CAS 119567-63-4), with molecular formula C20H41NO2 and molecular weight 327.31 g/mol. IUPAC: (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol.
Chemical Property Profile of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol
Property Insights of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol
The XLogP value of 6.3 indicates that (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol has 2 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 (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol?
The CAS number of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol is 119567-63-4.
What is the molecular formula of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol?
The molecular formula of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol is C20H41NO2.
What is the molecular weight of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol?
The molecular weight of (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol is 327.31 g/mol.
Where can I buy (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol?
You can request a quote for (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for (2S,3R)-2-(dimethylamino)octadec-4-ene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.