CBKinase1_007723
TL;DR: CBKinase1_007723 (CAS 488794-49-6) is a chemical compound with molecular formula C28H28N4O3S and molecular weight 500.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[13,13-dimethyl-6-(4-methylphenyl)-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]-N-methyl-N-phenylacetamide
Also Known As: CBKinase1_007723, CBKinase1_020123, BRD-K94040755-001-01-3, 2-((8,8-dimethyl-4-oxo-3-(p-tolyl)-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-methyl-N-phenylacetamide, 2-[[8,8-dimethyl-3-(4-methylphenyl)-4-oxo-6,9-dihydropyrano[3,4]pyrido[3,5-b]pyrimidin-2-yl]sulfanyl]-N-methyl-N-phenylacetamide
| Molecular Formula | C28H28N4O3S |
|---|---|
| Molecular Weight | 500.19 g/mol |
| LogP | 4.69552 |
| Topological Polar Surface Area | 77.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 500.1882 |
| Heavy Atoms | 36 |
| Complexity | 1497.7615 |
Chemical Identifiers
| CAS Number | 488794-49-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(N=C4CC(OCC4=C3)(C)C)N=C2SCC(=O)N(C)C5=CC=CC=C5 |
Product Overview
CBKinase1_007723 (CAS 488794-49-6), with molecular formula C28H28N4O3S and molecular weight 500.19 g/mol. IUPAC: 2-[[13,13-dimethyl-6-(4-methylphenyl)-7-oxo-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl]sulfanyl]-N-methyl-N-phenylacetamide.
Chemical Property Profile of CBKinase1_007723
Property Insights of CBKinase1_007723
The XLogP value of 4.69552 indicates that CBKinase1_007723 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.32 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007723. Following Lipinski's Rule of Five, CBKinase1_007723 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_007723?
The CAS number of CBKinase1_007723 is 488794-49-6.
What is the molecular formula of CBKinase1_007723?
The molecular formula of CBKinase1_007723 is C28H28N4O3S.
What is the molecular weight of CBKinase1_007723?
The molecular weight of CBKinase1_007723 is 500.19 g/mol.
Where can I buy CBKinase1_007723?
You can request a quote for CBKinase1_007723 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007723?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007723 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.