CBKinase1_010837
TL;DR: CBKinase1_010837 (CAS 766526-71-0) is a chemical compound with molecular formula C22H17N5OS and molecular weight 399.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]-N-phenylthiophene-2-carboxamide
Also Known As: CBKinase1_010837, CBKinase1_023237, BRD-K69209551-001-01-1, N-[(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]-N-phenylthiophene-2-carboxamide, N-[(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]-N-phenylthiophene-2-carboxamide
| Molecular Formula | C22H17N5OS |
|---|---|
| Molecular Weight | 399.12 g/mol |
| LogP | 4.49442 |
| Topological Polar Surface Area | 63.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.1154 |
| Heavy Atoms | 29 |
| Complexity | 1311.5775 |
Chemical Identifiers
| CAS Number | 766526-71-0 |
|---|---|
| SMILES | CC1=NN2C(=NN=C2C3=CC=CC=C13)CN(C4=CC=CC=C4)C(=O)C5=CC=CS5 |
Product Overview
CBKinase1_010837 (CAS 766526-71-0), with molecular formula C22H17N5OS and molecular weight 399.12 g/mol. IUPAC: N-[(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)methyl]-N-phenylthiophene-2-carboxamide.
Chemical Property Profile of CBKinase1_010837
Property Insights of CBKinase1_010837
The XLogP value of 4.49442 indicates that CBKinase1_010837 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.39 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_010837. Following Lipinski's Rule of Five, CBKinase1_010837 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 CBKinase1_010837?
The CAS number of CBKinase1_010837 is 766526-71-0.
What is the molecular formula of CBKinase1_010837?
The molecular formula of CBKinase1_010837 is C22H17N5OS.
What is the molecular weight of CBKinase1_010837?
The molecular weight of CBKinase1_010837 is 399.12 g/mol.
Where can I buy CBKinase1_010837?
You can request a quote for CBKinase1_010837 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_010837?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_010837 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.