CBKinase1_011497
TL;DR: CBKinase1_011497 (CAS 690247-47-3) is a chemical compound with molecular formula C22H26N2O6S2 and molecular weight 478.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-methyl-3-morpholin-4-ylsulfonylbenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: CBKinase1_011497, CBKinase1_023897, BRD-K17622375-001-01-2, F1651-0109, ETHYL 2-[4-METHYL-3-(MORPHOLINE-4-SULFONYL)BENZAMIDO]-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C22H26N2O6S2 |
|---|---|
| Molecular Weight | 478.12 g/mol |
| LogP | 2.99512 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.12323 |
| Heavy Atoms | 32 |
| Complexity | 1149.4111 |
Chemical Identifiers
| CAS Number | 690247-47-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCOCC4 |
Product Overview
CBKinase1_011497 (CAS 690247-47-3), with molecular formula C22H26N2O6S2 and molecular weight 478.12 g/mol. IUPAC: ethyl 2-[(4-methyl-3-morpholin-4-ylsulfonylbenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_011497
Property Insights of CBKinase1_011497
The XLogP value of 2.99512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_011497. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011497. Following Lipinski's Rule of Five, CBKinase1_011497 has 1 hydrogen bond donor(s) and 7 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_011497?
The CAS number of CBKinase1_011497 is 690247-47-3.
What is the molecular formula of CBKinase1_011497?
The molecular formula of CBKinase1_011497 is C22H26N2O6S2.
What is the molecular weight of CBKinase1_011497?
The molecular weight of CBKinase1_011497 is 478.12 g/mol.
Where can I buy CBKinase1_011497?
You can request a quote for CBKinase1_011497 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011497?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011497 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.