CBKinase1_007077
TL;DR: CBKinase1_007077 (CAS 329907-71-3) is a chemical compound with molecular formula C17H21N3O2S2 and molecular weight 363.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]-N-(oxolan-2-ylmethyl)acetamide
Also Known As: CBKinase1_007077, CBKinase1_019477, BRD-A09385471-001-01-1, F1142-3590, 2-((2-methyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-N-((tetrahydrofuran-2-yl)methyl)acetamide
| Molecular Formula | C17H21N3O2S2 |
|---|---|
| Molecular Weight | 363.11 g/mol |
| LogP | 2.87572 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.1075 |
| Heavy Atoms | 24 |
| Complexity | 768.77167 |
Chemical Identifiers
| CAS Number | 329907-71-3 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCC3)C(=N1)SCC(=O)NCC4CCCO4 |
Product Overview
CBKinase1_007077 (CAS 329907-71-3), with molecular formula C17H21N3O2S2 and molecular weight 363.11 g/mol. IUPAC: 2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]-N-(oxolan-2-ylmethyl)acetamide.
Chemical Property Profile of CBKinase1_007077
Property Insights of CBKinase1_007077
The XLogP value of 2.87572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007077. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007077. Following Lipinski's Rule of Five, CBKinase1_007077 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_007077?
The CAS number of CBKinase1_007077 is 329907-71-3.
What is the molecular formula of CBKinase1_007077?
The molecular formula of CBKinase1_007077 is C17H21N3O2S2.
What is the molecular weight of CBKinase1_007077?
The molecular weight of CBKinase1_007077 is 363.11 g/mol.
Where can I buy CBKinase1_007077?
You can request a quote for CBKinase1_007077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007077?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.