5-22-14-00461 (Beilstein Handbook Reference)
TL;DR: 5-22-14-00461 (Beilstein Handbook Reference) (CAS 52157-92-3) is a chemical compound with molecular formula C16H16F3N3O3S and molecular weight 387.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[3-(trifluoromethyl)anilino]-3-pyridinyl]sulfonyl]butanamide
Also Known As: 5-22-14-00461 (Beilstein Handbook Reference), N-((4-((3-(Trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)butanamide, Butanamide, N-((4-((3-(trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)-, N-[4-[3-(trifluoromethyl)anilino]pyridin-3-yl]sulfonylbutanamide, N-(4-((3-(Trifluoromethyl)phenyl)imino)-1,4-dihydropyridine-3-sulfonyl)butanimidic acid
| Molecular Formula | C16H16F3N3O3S |
|---|---|
| Molecular Weight | 387.09 g/mol |
| LogP | 3.449 |
| Topological Polar Surface Area | 88.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.08646 |
| Heavy Atoms | 26 |
| Complexity | 898.8533 |
Chemical Identifiers
| CAS Number | 52157-92-3 |
|---|---|
| SMILES | CCCC(=O)NS(=O)(=O)C1=C(C=CN=C1)NC2=CC=CC(=C2)C(F)(F)F |
Product Overview
5-22-14-00461 (Beilstein Handbook Reference) (CAS 52157-92-3), with molecular formula C16H16F3N3O3S and molecular weight 387.09 g/mol. IUPAC: N-[[4-[3-(trifluoromethyl)anilino]-3-pyridinyl]sulfonyl]butanamide.
Chemical Property Profile of 5-22-14-00461 (Beilstein Handbook Reference)
Property Insights of 5-22-14-00461 (Beilstein Handbook Reference)
The XLogP value of 3.449 indicates that 5-22-14-00461 (Beilstein Handbook Reference) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-22-14-00461 (Beilstein Handbook Reference). Following Lipinski's Rule of Five, 5-22-14-00461 (Beilstein Handbook Reference) has 2 hydrogen bond donor(s) and 5 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 5-22-14-00461 (Beilstein Handbook Reference)?
The CAS number of 5-22-14-00461 (Beilstein Handbook Reference) is 52157-92-3.
What is the molecular formula of 5-22-14-00461 (Beilstein Handbook Reference)?
The molecular formula of 5-22-14-00461 (Beilstein Handbook Reference) is C16H16F3N3O3S.
What is the molecular weight of 5-22-14-00461 (Beilstein Handbook Reference)?
The molecular weight of 5-22-14-00461 (Beilstein Handbook Reference) is 387.09 g/mol.
Where can I buy 5-22-14-00461 (Beilstein Handbook Reference)?
You can request a quote for 5-22-14-00461 (Beilstein Handbook Reference) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-22-14-00461 (Beilstein Handbook Reference)?
Yes, KEHONG BIO provides custom synthesis services for 5-22-14-00461 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.