CBKinase1_005947
TL;DR: CBKinase1_005947 (CAS 634166-48-6) is a chemical compound with molecular formula C20H19N7O3S and molecular weight 437.13 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-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide
Also Known As: CBKinase1_005947, CBKinase1_018347, BRD-K45552008-001-01-2, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-((1-(4-hydroxyphenyl)-1H-tetrazol-5-yl)thio)acetamide
| Molecular Formula | C20H19N7O3S |
|---|---|
| Molecular Weight | 437.13 g/mol |
| LogP | 1.89652 |
| Topological Polar Surface Area | 119.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.127 |
| Heavy Atoms | 31 |
| Complexity | 1276.6033 |
Chemical Identifiers
| CAS Number | 634166-48-6 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NN=NN3C4=CC=C(C=C4)O |
Product Overview
CBKinase1_005947 (CAS 634166-48-6), with molecular formula C20H19N7O3S and molecular weight 437.13 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanylacetamide.
Chemical Property Profile of CBKinase1_005947
Property Insights of CBKinase1_005947
The XLogP value of 1.89652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_005947. The TPSA of 119.86 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005947. Following Lipinski's Rule of Five, CBKinase1_005947 has 2 hydrogen bond donor(s) and 7 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_005947?
The CAS number of CBKinase1_005947 is 634166-48-6.
What is the molecular formula of CBKinase1_005947?
The molecular formula of CBKinase1_005947 is C20H19N7O3S.
What is the molecular weight of CBKinase1_005947?
The molecular weight of CBKinase1_005947 is 437.13 g/mol.
Where can I buy CBKinase1_005947?
You can request a quote for CBKinase1_005947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005947?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.