CBKinase1_009041
TL;DR: CBKinase1_009041 (CAS 690247-14-4) is a chemical compound with molecular formula C24H30N2O5S2 and molecular weight 490.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-(azepan-1-ylsulfonyl)-4-methylbenzoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: CBKinase1_009041, CBKinase1_021441, BRD-K25449328-001-01-8, F1651-0075, ethyl 2-(3-(azepan-1-ylsulfonyl)-4-methylbenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C24H30N2O5S2 |
|---|---|
| Molecular Weight | 490.16 g/mol |
| LogP | 4.53892 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 490.1596 |
| Heavy Atoms | 33 |
| Complexity | 1161.7576 |
Chemical Identifiers
| CAS Number | 690247-14-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCCCCC4 |
Product Overview
CBKinase1_009041 (CAS 690247-14-4), with molecular formula C24H30N2O5S2 and molecular weight 490.16 g/mol. IUPAC: ethyl 2-[[3-(azepan-1-ylsulfonyl)-4-methylbenzoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_009041
Property Insights of CBKinase1_009041
The XLogP value of 4.53892 indicates that CBKinase1_009041 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_009041. Following Lipinski's Rule of Five, CBKinase1_009041 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_009041?
The CAS number of CBKinase1_009041 is 690247-14-4.
What is the molecular formula of CBKinase1_009041?
The molecular formula of CBKinase1_009041 is C24H30N2O5S2.
What is the molecular weight of CBKinase1_009041?
The molecular weight of CBKinase1_009041 is 490.16 g/mol.
Where can I buy CBKinase1_009041?
You can request a quote for CBKinase1_009041 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_009041?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_009041 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.