CBKinase1_003898
TL;DR: CBKinase1_003898 (CAS 694458-26-9) is a chemical compound with molecular formula C19H17N5OS2 and molecular weight 395.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: CBKinase1_003898, CBKinase1_016298, BRD-K28163101-001-01-5, N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide, 2-[(4-METHYL-1,2,4-TRIAZOL-3-YL)SULFANYL]-N-[4-(6-METHYL-1,3-BENZOTHIAZOL-2-YL)PHENYL]ACETAMIDE
| Molecular Formula | C19H17N5OS2 |
|---|---|
| Molecular Weight | 395.09 g/mol |
| LogP | 4.13102 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.08746 |
| Heavy Atoms | 27 |
| Complexity | 1100.951 |
Chemical Identifiers
| CAS Number | 694458-26-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CSC4=NN=CN4C |
Product Overview
CBKinase1_003898 (CAS 694458-26-9), with molecular formula C19H17N5OS2 and molecular weight 395.09 g/mol. IUPAC: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_003898
Property Insights of CBKinase1_003898
The XLogP value of 4.13102 indicates that CBKinase1_003898 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003898. Following Lipinski's Rule of Five, CBKinase1_003898 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_003898?
The CAS number of CBKinase1_003898 is 694458-26-9.
What is the molecular formula of CBKinase1_003898?
The molecular formula of CBKinase1_003898 is C19H17N5OS2.
What is the molecular weight of CBKinase1_003898?
The molecular weight of CBKinase1_003898 is 395.09 g/mol.
Where can I buy CBKinase1_003898?
You can request a quote for CBKinase1_003898 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003898?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003898 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.