A3769/0159893
TL;DR: A3769/0159893 (CAS 727675-67-4) is a chemical compound with molecular formula C23H26N6O3S and molecular weight 466.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]sulfonylpiperazin-1-yl]ethanol
Also Known As: A3769/0159893, 2-(4-{[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]sulfonyl}piperazin-1-yl)ethanol, 2-(4-((2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl)sulfonyl)piperazin-1-yl)ethanol, 2-[4-(2-METHYL-5-{3-METHYL-[1,2,4]TRIAZOLO[3,4-A]PHTHALAZIN-6-YL}BENZENESULFONYL)PIPERAZIN-1-YL]ETHAN-1-OL, 2-[4-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]sulfonylpiperazin-1-yl]ethanol
| Molecular Formula | C23H26N6O3S |
|---|---|
| Molecular Weight | 466.18 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.1787 |
| Heavy Atoms | 33 |
| Complexity | 771.0 |
Chemical Identifiers
| CAS Number | 727675-67-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C)S(=O)(=O)N5CCN(CC5)CCO |
| InChIKey | YPZSHIURJOTAPW-UHFFFAOYSA-N |
Product Overview
A3769/0159893 (CAS 727675-67-4), with molecular formula C23H26N6O3S and molecular weight 466.18 g/mol. IUPAC: 2-[4-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]sulfonylpiperazin-1-yl]ethanol.
Chemical Property Profile of A3769/0159893
Property Insights of A3769/0159893
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3769/0159893. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A3769/0159893. Following Lipinski's Rule of Five, A3769/0159893 has 1 hydrogen bond donor(s) and 8 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 A3769/0159893?
The CAS number of A3769/0159893 is 727675-67-4.
What is the molecular formula of A3769/0159893?
The molecular formula of A3769/0159893 is C23H26N6O3S.
What is the molecular weight of A3769/0159893?
The molecular weight of A3769/0159893 is 466.18 g/mol.
Where can I buy A3769/0159893?
You can request a quote for A3769/0159893 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3769/0159893?
Yes, KEHONG BIO provides custom synthesis services for A3769/0159893 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.