ChemDiv3_006786
TL;DR: ChemDiv3_006786 (CAS 844882-56-0) is a chemical compound with molecular formula C23H26N6O4S and molecular weight 482.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-N-(2-morpholin-4-ylethyl)benzenesulfonamide
Also Known As: ChemDiv3_006786, IDI1_024696, A3701/0156947, BRD-K72920219-003-01-8, {[4-methoxy-3-(5-methyl(7-hydro-1,2,4-triazolo[3,4-a]phthalazin-8-yl))phenyl]s ulfonyl}(2-morpholin-4-ylethyl)amine
| Molecular Formula | C23H26N6O4S |
|---|---|
| Molecular Weight | 482.17 g/mol |
| LogP | 1.87202 |
| Topological Polar Surface Area | 110.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 482.1736 |
| Heavy Atoms | 34 |
| Complexity | 1446.9023 |
Chemical Identifiers
| CAS Number | 844882-56-0 |
|---|---|
| SMILES | CC1=NN2C(=NN=C2C3=C(C=CC(=C3)S(=O)(=O)NCCN4CCOCC4)OC)C5=CC=CC=C15 |
Product Overview
ChemDiv3_006786 (CAS 844882-56-0), with molecular formula C23H26N6O4S and molecular weight 482.17 g/mol. IUPAC: 4-methoxy-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)-N-(2-morpholin-4-ylethyl)benzenesulfonamide.
Chemical Property Profile of ChemDiv3_006786
Property Insights of ChemDiv3_006786
The XLogP value of 1.87202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_006786. The TPSA of 110.95 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_006786. Following Lipinski's Rule of Five, ChemDiv3_006786 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 ChemDiv3_006786?
The CAS number of ChemDiv3_006786 is 844882-56-0.
What is the molecular formula of ChemDiv3_006786?
The molecular formula of ChemDiv3_006786 is C23H26N6O4S.
What is the molecular weight of ChemDiv3_006786?
The molecular weight of ChemDiv3_006786 is 482.17 g/mol.
Where can I buy ChemDiv3_006786?
You can request a quote for ChemDiv3_006786 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_006786?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_006786 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.