4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
TL;DR: 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide (CAS 356586-28-2) is a chemical compound with molecular formula C18H13F6N5O2S2 and molecular weight 509.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1-pyridinyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide
Also Known As: 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide, A2336/0098597, 4-[2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)pyridin-1-yl]-N-(1,3-thiazol-2-yl)benzenesulfonamide, 2-amino-4,4-bis(trifluoromethyl)-6-methyl-1-{4-[(1,3-thiazol-2-ylamino)sulfony l]phenyl}-1,4-dihydropyridine-3-carbonitrile, 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)pyridin-1(4H)-yl)-N-(thiazol-2-yl)benzenesulfonamide
| Molecular Formula | C18H13F6N5O2S2 |
|---|---|
| Molecular Weight | 509.04 g/mol |
| LogP | 4.47258 |
| Topological Polar Surface Area | 112.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 509.04147 |
| Heavy Atoms | 33 |
| Complexity | 1243.3741 |
Chemical Identifiers
| CAS Number | 356586-28-2 |
|---|---|
| SMILES | CC1=CC(C(=C(N1C2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)N)C#N)(C(F)(F)F)C(F)(F)F |
Product Overview
4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide (CAS 356586-28-2), with molecular formula C18H13F6N5O2S2 and molecular weight 509.04 g/mol. IUPAC: 4-[2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1-pyridinyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide.
Chemical Property Profile of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
Property Insights of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
The XLogP value of 4.47258 indicates that 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The CAS number of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide is 356586-28-2.
What is the molecular formula of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The molecular formula of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide is C18H13F6N5O2S2.
What is the molecular weight of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide?
The molecular weight of 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide is 509.04 g/mol.
Where can I buy 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide?
You can request a quote for 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)-1(4H)-pyridinyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.