CBKinase1_005375
TL;DR: CBKinase1_005375 (CAS 727688-89-3) is a chemical compound with molecular formula C22H14ClN5OS3 and molecular weight 495.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-N-(5-phenyl-1,2,4-thiadiazol-3-yl)acetamide
Also Known As: CBKinase1_005375, CBKinase1_017775, BRD-K38712472-001-01-8, F3394-0623, 2-{[5-(4-CHLOROPHENYL)THIENO[2,3-D]PYRIMIDIN-4-YL]SULFANYL}-N-(5-PHENYL-1,2,4-THIADIAZOL-3-YL)ACETAMIDE
| Molecular Formula | C22H14ClN5OS3 |
|---|---|
| Molecular Weight | 495.00 g/mol |
| LogP | 6.261 |
| Topological Polar Surface Area | 80.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.0049 |
| Heavy Atoms | 32 |
| Complexity | 1386.0105 |
Chemical Identifiers
| CAS Number | 727688-89-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=NS2)NC(=O)CSC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)Cl |
Product Overview
CBKinase1_005375 (CAS 727688-89-3), with molecular formula C22H14ClN5OS3 and molecular weight 495.00 g/mol. IUPAC: 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-N-(5-phenyl-1,2,4-thiadiazol-3-yl)acetamide.
Chemical Property Profile of CBKinase1_005375
Property Insights of CBKinase1_005375
The XLogP value of 6.261 indicates that CBKinase1_005375 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.66 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_005375. Following Lipinski's Rule of Five, CBKinase1_005375 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_005375?
The CAS number of CBKinase1_005375 is 727688-89-3.
What is the molecular formula of CBKinase1_005375?
The molecular formula of CBKinase1_005375 is C22H14ClN5OS3.
What is the molecular weight of CBKinase1_005375?
The molecular weight of CBKinase1_005375 is 495.00 g/mol.
Where can I buy CBKinase1_005375?
You can request a quote for CBKinase1_005375 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005375?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005375 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.