CBKinase1_001649
TL;DR: CBKinase1_001649 (CAS 431883-23-7) is a chemical compound with molecular formula C21H25NO4S and molecular weight 387.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: CBKinase1_001649, CBKinase1_014049, AE-641/15339308, BRD-K42162967-001-01-2, methyl 2-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C21H25NO4S |
|---|---|
| Molecular Weight | 387.15 g/mol |
| LogP | 4.47272 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.15042 |
| Heavy Atoms | 27 |
| Complexity | 869.3068 |
Chemical Identifiers
| CAS Number | 431883-23-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)C(C)C |
Product Overview
CBKinase1_001649 (CAS 431883-23-7), with molecular formula C21H25NO4S and molecular weight 387.15 g/mol. IUPAC: methyl 2-[[2-(3-methyl-4-propan-2-ylphenoxy)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_001649
Property Insights of CBKinase1_001649
The XLogP value of 4.47272 indicates that CBKinase1_001649 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001649. Following Lipinski's Rule of Five, CBKinase1_001649 has 1 hydrogen bond donor(s) and 5 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_001649?
The CAS number of CBKinase1_001649 is 431883-23-7.
What is the molecular formula of CBKinase1_001649?
The molecular formula of CBKinase1_001649 is C21H25NO4S.
What is the molecular weight of CBKinase1_001649?
The molecular weight of CBKinase1_001649 is 387.15 g/mol.
Where can I buy CBKinase1_001649?
You can request a quote for CBKinase1_001649 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001649?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001649 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.