CBKinase1_010177
TL;DR: CBKinase1_010177 (CAS 714203-89-1) is a chemical compound with molecular formula C22H25N3O4S2 and molecular weight 459.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: CBKinase1_010177, CBKinase1_022577, ethyl 2-({[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C22H25N3O4S2 |
|---|---|
| Molecular Weight | 459.13 g/mol |
| LogP | 4.70262 |
| Topological Polar Surface Area | 103.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 459.12866 |
| Heavy Atoms | 31 |
| Complexity | 1165.6627 |
Chemical Identifiers
| CAS Number | 714203-89-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C4=C(C=C(N=C4S3)C)COC)N |
Product Overview
CBKinase1_010177 (CAS 714203-89-1), with molecular formula C22H25N3O4S2 and molecular weight 459.13 g/mol. IUPAC: ethyl 2-[[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridine-2-carbonyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_010177
Property Insights of CBKinase1_010177
The XLogP value of 4.70262 indicates that CBKinase1_010177 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.54 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_010177. Following Lipinski's Rule of Five, CBKinase1_010177 has 2 hydrogen bond donor(s) and 8 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_010177?
The CAS number of CBKinase1_010177 is 714203-89-1.
What is the molecular formula of CBKinase1_010177?
The molecular formula of CBKinase1_010177 is C22H25N3O4S2.
What is the molecular weight of CBKinase1_010177?
The molecular weight of CBKinase1_010177 is 459.13 g/mol.
Where can I buy CBKinase1_010177?
You can request a quote for CBKinase1_010177 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_010177?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_010177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.