N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide
TL;DR: N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide (CAS 488111-30-4) is a chemical compound with molecular formula C21H19F6N3OS and molecular weight 475.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide
Also Known As: N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide, N-[2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide, N-{2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-3-phenylpropanamide
| Molecular Formula | C21H19F6N3OS |
|---|---|
| Molecular Weight | 475.12 g/mol |
| LogP | 5.89494 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 475.1153 |
| Heavy Atoms | 32 |
| Complexity | 1094.4059 |
Chemical Identifiers
| CAS Number | 488111-30-4 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)SC(=N2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)CCC3=CC=CC=C3)C |
Product Overview
N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide (CAS 488111-30-4), with molecular formula C21H19F6N3OS and molecular weight 475.12 g/mol. IUPAC: N-[2-[(4,5-dimethyl-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]-3-phenylpropanamide.
Chemical Property Profile of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide
Property Insights of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide
The XLogP value of 5.89494 indicates that N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.02 Ų, N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
The CAS number of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is 488111-30-4.
What is the molecular formula of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
The molecular formula of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is C21H19F6N3OS.
What is the molecular weight of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
The molecular weight of N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide is 475.12 g/mol.
Where can I buy N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
You can request a quote for N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-((4,5-dimethylbenzo[d]thiazol-2-yl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.