A3802/0161344
TL;DR: A3802/0161344 (CAS 727686-21-7) is a chemical compound with molecular formula C23H20N6O2S and molecular weight 444.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,2-trimethyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide
Also Known As: A3802/0161344, N,N,2-trimethyl-5-(3-(pyridin-4-yl)-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide, N,N,2-trimethyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide, N,N,2-trimethyl-5-[3-(pyridin-4-yl)[1,2,4]triazolo[3,4-a]phthalazin-6-yl]benzenesulfonamide, N~1~,N~1~,2-TRIMETHYL-5-[3-(4-PYRIDYL)[1,2,4]TRIAZOLO[3,4-A]PHTHALAZIN-6-YL]-1-BENZENESULFONAMIDE
| Molecular Formula | C23H20N6O2S |
|---|---|
| Molecular Weight | 444.14 g/mol |
| LogP | 3.56522 |
| Topological Polar Surface Area | 93.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.13684 |
| Heavy Atoms | 32 |
| Complexity | 1577.0469 |
Chemical Identifiers
| CAS Number | 727686-21-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC=NC=C5)S(=O)(=O)N(C)C |
Product Overview
A3802/0161344 (CAS 727686-21-7), with molecular formula C23H20N6O2S and molecular weight 444.14 g/mol. IUPAC: N,N,2-trimethyl-5-(3-pyridin-4-yl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)benzenesulfonamide.
Chemical Property Profile of A3802/0161344
Property Insights of A3802/0161344
The XLogP value of 3.56522 indicates that A3802/0161344 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.35 Ų falls within the moderate polarity range, balancing permeability and solubility for A3802/0161344. Following Lipinski's Rule of Five, A3802/0161344 has 0 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 A3802/0161344?
The CAS number of A3802/0161344 is 727686-21-7.
What is the molecular formula of A3802/0161344?
The molecular formula of A3802/0161344 is C23H20N6O2S.
What is the molecular weight of A3802/0161344?
The molecular weight of A3802/0161344 is 444.14 g/mol.
Where can I buy A3802/0161344?
You can request a quote for A3802/0161344 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3802/0161344?
Yes, KEHONG BIO provides custom synthesis services for A3802/0161344 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.