CBKinase1_002979
TL;DR: CBKinase1_002979 (CAS 692771-30-5) is a chemical compound with molecular formula C27H22FN3O3S and molecular weight 487.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,4-dihydropyridine-3-carboxamide
Also Known As: CBKinase1_002979, CBKinase1_015379, 5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,4-dihydropyridine-3-carboxamide, 5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-((2-oxo-2-(p-tolyl)ethyl)thio)-1,4-dihydropyridine-3-carboxamide, 5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C27H22FN3O3S |
|---|---|
| Molecular Weight | 487.14 g/mol |
| LogP | 5.6779 |
| Topological Polar Surface Area | 95.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.1366 |
| Heavy Atoms | 35 |
| Complexity | 1369.408 |
Chemical Identifiers
| CAS Number | 692771-30-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3F)C4=CC=CO4)C#N |
Product Overview
CBKinase1_002979 (CAS 692771-30-5), with molecular formula C27H22FN3O3S and molecular weight 487.14 g/mol. IUPAC: 5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of CBKinase1_002979
Property Insights of CBKinase1_002979
The XLogP value of 5.6779 indicates that CBKinase1_002979 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.13 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002979. Following Lipinski's Rule of Five, CBKinase1_002979 has 2 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_002979?
The CAS number of CBKinase1_002979 is 692771-30-5.
What is the molecular formula of CBKinase1_002979?
The molecular formula of CBKinase1_002979 is C27H22FN3O3S.
What is the molecular weight of CBKinase1_002979?
The molecular weight of CBKinase1_002979 is 487.14 g/mol.
Where can I buy CBKinase1_002979?
You can request a quote for CBKinase1_002979 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002979?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002979 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.