CBKinase1_001528
TL;DR: CBKinase1_001528 (CAS 383164-79-2) is a chemical compound with molecular formula C27H18ClN5O2S and molecular weight 511.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-one
Also Known As: CBKinase1_001528, CBKinase1_013928, BRD-K53502987-001-01-1, 3-(2-chlorophenyl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-one, 3-(2-chlorophenyl)-2-(((5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)methyl)quinazolin-4(3H)-one
| Molecular Formula | C27H18ClN5O2S |
|---|---|
| Molecular Weight | 511.09 g/mol |
| LogP | 6.1721 |
| Topological Polar Surface Area | 78.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 511.08698 |
| Heavy Atoms | 36 |
| Complexity | 1729.0577 |
Chemical Identifiers
| CAS Number | 383164-79-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5Cl)C6=CC=CO6 |
Product Overview
CBKinase1_001528 (CAS 383164-79-2), with molecular formula C27H18ClN5O2S and molecular weight 511.09 g/mol. IUPAC: 3-(2-chlorophenyl)-2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-one.
Chemical Property Profile of CBKinase1_001528
Property Insights of CBKinase1_001528
The XLogP value of 6.1721 indicates that CBKinase1_001528 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.74 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001528. Following Lipinski's Rule of Five, CBKinase1_001528 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_001528?
The CAS number of CBKinase1_001528 is 383164-79-2.
What is the molecular formula of CBKinase1_001528?
The molecular formula of CBKinase1_001528 is C27H18ClN5O2S.
What is the molecular weight of CBKinase1_001528?
The molecular weight of CBKinase1_001528 is 511.09 g/mol.
Where can I buy CBKinase1_001528?
You can request a quote for CBKinase1_001528 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001528?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001528 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.