CBKinase1_006700
TL;DR: CBKinase1_006700 (CAS 708218-58-0) is a chemical compound with molecular formula C19H19ClN6O3S and molecular weight 446.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-morpholin-4-ylphenyl)-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide
Also Known As: CBKinase1_006700, CBKinase1_019100, AB00352165-09, BRD-K13142993-001-01-7, N-(3-chloro-4-morpholin-4-ylphenyl)-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide
| Molecular Formula | C19H19ClN6O3S |
|---|---|
| Molecular Weight | 446.09 g/mol |
| LogP | 2.5887 |
| Topological Polar Surface Area | 105.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.09277 |
| Heavy Atoms | 30 |
| Complexity | 1023.36414 |
Chemical Identifiers
| CAS Number | 708218-58-0 |
|---|---|
| SMILES | C1COCCN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=NN3C4=CC=C(C=C4)O)Cl |
Product Overview
CBKinase1_006700 (CAS 708218-58-0), with molecular formula C19H19ClN6O3S and molecular weight 446.09 g/mol. IUPAC: N-(3-chloro-4-morpholin-4-ylphenyl)-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide.
Chemical Property Profile of CBKinase1_006700
Property Insights of CBKinase1_006700
The XLogP value of 2.5887 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_006700. The TPSA of 105.4 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006700. Following Lipinski's Rule of Five, CBKinase1_006700 has 2 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 CBKinase1_006700?
The CAS number of CBKinase1_006700 is 708218-58-0.
What is the molecular formula of CBKinase1_006700?
The molecular formula of CBKinase1_006700 is C19H19ClN6O3S.
What is the molecular weight of CBKinase1_006700?
The molecular weight of CBKinase1_006700 is 446.09 g/mol.
Where can I buy CBKinase1_006700?
You can request a quote for CBKinase1_006700 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006700?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006700 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.