RefChem:272143
TL;DR: RefChem:272143 (CAS 110525-41-2) is a chemical compound with molecular formula C22H27F2NO4S and molecular weight 439.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 4-[2-(difluoromethylsulfanyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-((difluoromethyl)thio)phenyl)-2,6-dimethyl-, bis(1-methylethyl) ester, 1,3,2-Oxathiaborinane,2,5-bis(1-methylethyl), 2,6-Dimethyl-3,5-di(isopropoxycarbonyl)-4-(o-difluoromethylthiophenyl)-1,4-dihydropyridine, dipropan-2-yl 4-[2-(difluoromethylsulfanyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2-((difluoromethyl)thio) phenyl)-2,6-dimethyl-, bis(1-
| Molecular Formula | C22H27F2NO4S |
|---|---|
| Molecular Weight | 439.16 g/mol |
| LogP | 5.1393 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.16287 |
| Heavy Atoms | 30 |
| Complexity | 833.64343 |
Chemical Identifiers
| CAS Number | 110525-41-2 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC=CC=C2SC(F)F)C(=O)OC(C)C |
Product Overview
RefChem:272143 (CAS 110525-41-2), with molecular formula C22H27F2NO4S and molecular weight 439.16 g/mol. IUPAC: dipropan-2-yl 4-[2-(difluoromethylsulfanyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of RefChem:272143
Property Insights of RefChem:272143
The XLogP value of 5.1393 indicates that RefChem:272143 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:272143. Following Lipinski's Rule of Five, RefChem:272143 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:272143?
The CAS number of RefChem:272143 is 110525-41-2.
What is the molecular formula of RefChem:272143?
The molecular formula of RefChem:272143 is C22H27F2NO4S.
What is the molecular weight of RefChem:272143?
The molecular weight of RefChem:272143 is 439.16 g/mol.
Where can I buy RefChem:272143?
You can request a quote for RefChem:272143 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:272143?
Yes, KEHONG BIO provides custom synthesis services for RefChem:272143 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.