AB00734006-01
TL;DR: AB00734006-01 (CAS 854022-82-5) is a chemical compound with molecular formula C16H10ClF3N4O2 and molecular weight 382.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
Also Known As: AB00734006-01, N-(4-chloro-3-(trifluoromethyl)phenyl)-2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
| Molecular Formula | C16H10ClF3N4O2 |
|---|---|
| Molecular Weight | 382.04 g/mol |
| LogP | 3.1024 |
| Topological Polar Surface Area | 76.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.04443 |
| Heavy Atoms | 26 |
| Complexity | 1049.5797 |
Chemical Identifiers
| CAS Number | 854022-82-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(N=N2)CC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F |
Product Overview
AB00734006-01 (CAS 854022-82-5), with molecular formula C16H10ClF3N4O2 and molecular weight 382.04 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide.
Chemical Property Profile of AB00734006-01
Property Insights of AB00734006-01
The XLogP value of 3.1024 indicates that AB00734006-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.88 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00734006-01. Following Lipinski's Rule of Five, AB00734006-01 has 1 hydrogen bond donor(s) and 4 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 AB00734006-01?
The CAS number of AB00734006-01 is 854022-82-5.
What is the molecular formula of AB00734006-01?
The molecular formula of AB00734006-01 is C16H10ClF3N4O2.
What is the molecular weight of AB00734006-01?
The molecular weight of AB00734006-01 is 382.04 g/mol.
Where can I buy AB00734006-01?
You can request a quote for AB00734006-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00734006-01?
Yes, KEHONG BIO provides custom synthesis services for AB00734006-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.