CBKinase1_001123
TL;DR: CBKinase1_001123 (CAS 330465-64-0) is a chemical compound with molecular formula C16H17N5O2S2 and molecular weight 375.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Also Known As: CBKinase1_001123, CBKinase1_013523, BIM-0036379.P001, BRD-K21989109-001-01-2, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
| Molecular Formula | C16H17N5O2S2 |
|---|---|
| Molecular Weight | 375.08 g/mol |
| LogP | 2.37514 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.08237 |
| Heavy Atoms | 25 |
| Complexity | 958.81305 |
Chemical Identifiers
| CAS Number | 330465-64-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NN=C(S3)C |
Product Overview
CBKinase1_001123 (CAS 330465-64-0), with molecular formula C16H17N5O2S2 and molecular weight 375.08 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_001123
Property Insights of CBKinase1_001123
The XLogP value of 2.37514 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_001123. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001123. Following Lipinski's Rule of Five, CBKinase1_001123 has 1 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 CBKinase1_001123?
The CAS number of CBKinase1_001123 is 330465-64-0.
What is the molecular formula of CBKinase1_001123?
The molecular formula of CBKinase1_001123 is C16H17N5O2S2.
What is the molecular weight of CBKinase1_001123?
The molecular weight of CBKinase1_001123 is 375.08 g/mol.
Where can I buy CBKinase1_001123?
You can request a quote for CBKinase1_001123 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001123?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001123 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.