BAS 10837982
TL;DR: BAS 10837982 (CAS 876721-23-2) is a chemical compound with molecular formula C22H23N5O2S and molecular weight 421.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-[1,2,4]triazolo[3,4-a]phthalazine
Also Known As: BAS 10837982, 3-methyl-6-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-[1,2,4]triazolo[3,4-a]phthalazine, 3-methyl-6-(4-methyl-3-(piperidin-1-ylsulfonyl)phenyl)-[1,2,4]triazolo[3,4-a]phthalazine, 3-methyl-6-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl][1,2,4]triazolo[3,4-a]phthalazine
| Molecular Formula | C22H23N5O2S |
|---|---|
| Molecular Weight | 421.16 g/mol |
| LogP | 3.73594 |
| Topological Polar Surface Area | 80.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.15726 |
| Heavy Atoms | 30 |
| Complexity | 1371.3234 |
Chemical Identifiers
| CAS Number | 876721-23-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C)S(=O)(=O)N5CCCCC5 |
Product Overview
BAS 10837982 (CAS 876721-23-2), with molecular formula C22H23N5O2S and molecular weight 421.16 g/mol. IUPAC: 3-methyl-6-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-[1,2,4]triazolo[3,4-a]phthalazine.
Chemical Property Profile of BAS 10837982
Property Insights of BAS 10837982
The XLogP value of 3.73594 indicates that BAS 10837982 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10837982. Following Lipinski's Rule of Five, BAS 10837982 has 0 hydrogen bond donor(s) and 5 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 BAS 10837982?
The CAS number of BAS 10837982 is 876721-23-2.
What is the molecular formula of BAS 10837982?
The molecular formula of BAS 10837982 is C22H23N5O2S.
What is the molecular weight of BAS 10837982?
The molecular weight of BAS 10837982 is 421.16 g/mol.
Where can I buy BAS 10837982?
You can request a quote for BAS 10837982 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10837982?
Yes, KEHONG BIO provides custom synthesis services for BAS 10837982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.