AB00110168-01
TL;DR: AB00110168-01 (CAS 347310-67-2) is a chemical compound with molecular formula C19H19F3N4O5S and molecular weight 472.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]acetamide
Also Known As: AB00110168-01, A2613/0111128, N-[4-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}sulfonyl)phenyl]acetamide, N-[4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]acetamide, N-(4-((4-(2-nitro-4-(trifluoromethyl)phenyl)piperazin-1-yl)sulfonyl)phenyl)acetamide
| Molecular Formula | C19H19F3N4O5S |
|---|---|
| Molecular Weight | 472.10 g/mol |
| LogP | 3.0829 |
| Topological Polar Surface Area | 112.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.1028 |
| Heavy Atoms | 32 |
| Complexity | 1128.6425 |
Chemical Identifiers
| CAS Number | 347310-67-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-] |
Product Overview
AB00110168-01 (CAS 347310-67-2), with molecular formula C19H19F3N4O5S and molecular weight 472.10 g/mol. IUPAC: N-[4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylphenyl]acetamide.
Chemical Property Profile of AB00110168-01
Property Insights of AB00110168-01
The XLogP value of 3.0829 indicates that AB00110168-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00110168-01. Following Lipinski's Rule of Five, AB00110168-01 has 1 hydrogen bond donor(s) and 6 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 AB00110168-01?
The CAS number of AB00110168-01 is 347310-67-2.
What is the molecular formula of AB00110168-01?
The molecular formula of AB00110168-01 is C19H19F3N4O5S.
What is the molecular weight of AB00110168-01?
The molecular weight of AB00110168-01 is 472.10 g/mol.
Where can I buy AB00110168-01?
You can request a quote for AB00110168-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00110168-01?
Yes, KEHONG BIO provides custom synthesis services for AB00110168-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.