CBKinase1_007891
TL;DR: CBKinase1_007891 (CAS 314261-72-8) is a chemical compound with molecular formula C17H17N3O2S2 and molecular weight 359.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(furan-2-ylmethyl)-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide
Also Known As: CBKinase1_007891, CBKinase1_020291, AF-399/15031097, N-(furan-2-ylmethyl)-2-((2-methyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)acetamide, BRD-K76889259-001-01-6
| Molecular Formula | C17H17N3O2S2 |
|---|---|
| Molecular Weight | 359.08 g/mol |
| LogP | 3.48992 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.07623 |
| Heavy Atoms | 24 |
| Complexity | 887.01294 |
Chemical Identifiers
| CAS Number | 314261-72-8 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCC3)C(=N1)SCC(=O)NCC4=CC=CO4 |
Product Overview
CBKinase1_007891 (CAS 314261-72-8), with molecular formula C17H17N3O2S2 and molecular weight 359.08 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_007891
Property Insights of CBKinase1_007891
The XLogP value of 3.48992 indicates that CBKinase1_007891 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007891. Following Lipinski's Rule of Five, CBKinase1_007891 has 1 hydrogen bond donor(s) and 6 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_007891?
The CAS number of CBKinase1_007891 is 314261-72-8.
What is the molecular formula of CBKinase1_007891?
The molecular formula of CBKinase1_007891 is C17H17N3O2S2.
What is the molecular weight of CBKinase1_007891?
The molecular weight of CBKinase1_007891 is 359.08 g/mol.
Where can I buy CBKinase1_007891?
You can request a quote for CBKinase1_007891 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007891?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007891 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.