CBKinase1_001001
TL;DR: CBKinase1_001001 (CAS 350998-82-2) is a chemical compound with molecular formula C20H21NO5S and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methoxycarbonyl-4-phenylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
Also Known As: CBKinase1_001001, CBKinase1_013401, BIM-0017893.P001, BRD-A15259634-001-01-4, 2-[(3-methoxycarbonyl-4-phenylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
| Molecular Formula | C20H21NO5S |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 4.0312 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.11404 |
| Heavy Atoms | 27 |
| Complexity | 845.3119 |
Chemical Identifiers
| CAS Number | 350998-82-2 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCCCC3C(=O)O |
Product Overview
CBKinase1_001001 (CAS 350998-82-2), with molecular formula C20H21NO5S and molecular weight 387.11 g/mol. IUPAC: 2-[(3-methoxycarbonyl-4-phenylthiophen-2-yl)carbamoyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of CBKinase1_001001
Property Insights of CBKinase1_001001
The XLogP value of 4.0312 indicates that CBKinase1_001001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001001. Following Lipinski's Rule of Five, CBKinase1_001001 has 2 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_001001?
The CAS number of CBKinase1_001001 is 350998-82-2.
What is the molecular formula of CBKinase1_001001?
The molecular formula of CBKinase1_001001 is C20H21NO5S.
What is the molecular weight of CBKinase1_001001?
The molecular weight of CBKinase1_001001 is 387.11 g/mol.
Where can I buy CBKinase1_001001?
You can request a quote for CBKinase1_001001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001001?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.