CBKinase1_007299
TL;DR: CBKinase1_007299 (CAS 708230-52-8) is a chemical compound with molecular formula C20H25N3O5S3 and molecular weight 483.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-ethyl-5-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbamothioylamino]thiophene-3-carboxylate
Also Known As: CBKinase1_007299, CBKinase1_019699, methyl 4-ethyl-5-methyl-2-({[3-(morpholin-4-ylsulfonyl)phenyl]carbamothioyl}amino)thiophene-3-carboxylate, methyl 4-ethyl-5-methyl-2-(3-(3-(morpholinosulfonyl)phenyl)thioureido)thiophene-3-carboxylate, methyl 4-ethyl-5-methyl-2-[({[3-(morpholin-4-ylsulfonyl)phenyl]amino}thioxomet hyl)amino]thiophene-3-carboxylate
| Molecular Formula | C20H25N3O5S3 |
|---|---|
| Molecular Weight | 483.10 g/mol |
| LogP | 3.23532 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 483.09564 |
| Heavy Atoms | 31 |
| Complexity | 1075.7247 |
Chemical Identifiers
| CAS Number | 708230-52-8 |
|---|---|
| SMILES | CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C |
Product Overview
CBKinase1_007299 (CAS 708230-52-8), with molecular formula C20H25N3O5S3 and molecular weight 483.10 g/mol. IUPAC: methyl 4-ethyl-5-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbamothioylamino]thiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_007299
Property Insights of CBKinase1_007299
The XLogP value of 3.23532 indicates that CBKinase1_007299 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007299. Following Lipinski's Rule of Five, CBKinase1_007299 has 2 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_007299?
The CAS number of CBKinase1_007299 is 708230-52-8.
What is the molecular formula of CBKinase1_007299?
The molecular formula of CBKinase1_007299 is C20H25N3O5S3.
What is the molecular weight of CBKinase1_007299?
The molecular weight of CBKinase1_007299 is 483.10 g/mol.
Where can I buy CBKinase1_007299?
You can request a quote for CBKinase1_007299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007299?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.