CBKinase1_004387
TL;DR: CBKinase1_004387 (CAS 342382-30-3) is a chemical compound with molecular formula C18H21N3O2S and molecular weight 343.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylpropanoylamino)-N-pyridin-3-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: CBKinase1_004387, CBKinase1_016787, BAS 06105278, AE-848/13196149, BRD-K06873238-001-01-1
| Molecular Formula | C18H21N3O2S |
|---|---|
| Molecular Weight | 343.14 g/mol |
| LogP | 3.8687 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.13544 |
| Heavy Atoms | 24 |
| Complexity | 753.1244 |
Chemical Identifiers
| CAS Number | 342382-30-3 |
|---|---|
| SMILES | CC(C)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)NC3=CN=CC=C3 |
Product Overview
CBKinase1_004387 (CAS 342382-30-3), with molecular formula C18H21N3O2S and molecular weight 343.14 g/mol. IUPAC: 2-(2-methylpropanoylamino)-N-pyridin-3-yl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of CBKinase1_004387
Property Insights of CBKinase1_004387
The XLogP value of 3.8687 indicates that CBKinase1_004387 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004387. Following Lipinski's Rule of Five, CBKinase1_004387 has 2 hydrogen bond donor(s) and 4 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_004387?
The CAS number of CBKinase1_004387 is 342382-30-3.
What is the molecular formula of CBKinase1_004387?
The molecular formula of CBKinase1_004387 is C18H21N3O2S.
What is the molecular weight of CBKinase1_004387?
The molecular weight of CBKinase1_004387 is 343.14 g/mol.
Where can I buy CBKinase1_004387?
You can request a quote for CBKinase1_004387 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004387?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004387 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.