R-278995
TL;DR: R-278995 (CAS 694491-71-9) is a chemical compound with molecular formula C28H25Cl2N3O4S and molecular weight 569.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfonic acid;1-[8-(2,4-dichlorophenyl)-2-methylquinolin-4-yl]-3,6-dihydro-2H-pyridine-4-carboxamide
Also Known As: R-278995, 4-Pyridinecarboxamide, 1-(8-(2,4-dichlorophenyl)-2-methyl-4-quinolinyl)-1,2,3,6-tetrahydro-, monobenzenesulfonate, 4-Pyridinecarboxamide, 1-(8-(2,4-dichlorophenyl)-2-methyl-4-quinolinyl)-1,2,3,6-tetrahydro-, benzenesulfonate (1:1)
| Molecular Formula | C28H25Cl2N3O4S |
|---|---|
| Molecular Weight | 569.09 g/mol |
| LogP | 6.07212 |
| Topological Polar Surface Area | 113.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 569.0943 |
| Heavy Atoms | 38 |
| Complexity | 1641.2454 |
Chemical Identifiers
| CAS Number | 694491-71-9 |
|---|---|
| SMILES | CC1=CC(=C2C=CC=C(C2=N1)C3=C(C=C(C=C3)Cl)Cl)N4CCC(=CC4)C(=O)N.C1=CC=C(C=C1)S(=O)(=O)O |
Product Overview
R-278995 (CAS 694491-71-9), with molecular formula C28H25Cl2N3O4S and molecular weight 569.09 g/mol. IUPAC: benzenesulfonic acid;1-[8-(2,4-dichlorophenyl)-2-methylquinolin-4-yl]-3,6-dihydro-2H-pyridine-4-carboxamide.
Chemical Property Profile of R-278995
Property Insights of R-278995
The XLogP value of 6.07212 indicates that R-278995 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.59 Ų falls within the moderate polarity range, balancing permeability and solubility for R-278995. Following Lipinski's Rule of Five, R-278995 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of R-278995?
The CAS number of R-278995 is 694491-71-9.
What is the molecular formula of R-278995?
The molecular formula of R-278995 is C28H25Cl2N3O4S.
What is the molecular weight of R-278995?
The molecular weight of R-278995 is 569.09 g/mol.
Where can I buy R-278995?
You can request a quote for R-278995 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for R-278995?
Yes, KEHONG BIO provides custom synthesis services for R-278995 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.