1,8-Octadecanediol
TL;DR: 1,8-Octadecanediol (CAS 6801-48-5) is a chemical compound with molecular formula C26H33N3O4S and molecular weight 483.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-hexyl-6-[methyl-(4-propan-2-ylphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
Also Known As: 1,8-Octadecanediol, N-hexyl-6-[methyl-(4-propan-2-ylphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide, K784-1110, N-HEXYL-6-{METHYL[4-(PROPAN-2-YL)PHENYL]SULFAMOYL}-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXAMIDE
| Molecular Formula | C26H33N3O4S |
|---|---|
| Molecular Weight | 483.22 g/mol |
| LogP | 4.7867 |
| Topological Polar Surface Area | 99.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 483.21918 |
| Heavy Atoms | 34 |
| Complexity | 1312.1204 |
Chemical Identifiers
| CAS Number | 6801-48-5 |
|---|---|
| SMILES | CCCCCCNC(=O)C1=CNC2=C(C1=O)C=C(C=C2)S(=O)(=O)N(C)C3=CC=C(C=C3)C(C)C |
Product Overview
1,8-Octadecanediol (CAS 6801-48-5), with molecular formula C26H33N3O4S and molecular weight 483.22 g/mol. IUPAC: N-hexyl-6-[methyl-(4-propan-2-ylphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide.
Chemical Property Profile of 1,8-Octadecanediol
Property Insights of 1,8-Octadecanediol
The XLogP value of 4.7867 indicates that 1,8-Octadecanediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8-Octadecanediol. Following Lipinski's Rule of Five, 1,8-Octadecanediol has 2 hydrogen bond donor(s) and 4 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 1,8-Octadecanediol?
The CAS number of 1,8-Octadecanediol is 6801-48-5.
What is the molecular formula of 1,8-Octadecanediol?
The molecular formula of 1,8-Octadecanediol is C26H33N3O4S.
What is the molecular weight of 1,8-Octadecanediol?
The molecular weight of 1,8-Octadecanediol is 483.22 g/mol.
Where can I buy 1,8-Octadecanediol?
You can request a quote for 1,8-Octadecanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8-Octadecanediol?
Yes, KEHONG BIO provides custom synthesis services for 1,8-Octadecanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.