CBKinase1_004299
TL;DR: CBKinase1_004299 (CAS 1008935-78-1) is a chemical compound with molecular formula C20H23N3O4S and molecular weight 401.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate
Also Known As: CBKinase1_004299, CBKinase1_016699, BAS 08951473, methyl 2-{[(6,7-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetyl]amino}-5-ethylthiophene-3-carboxylate, methyl 2-[2-(6,7-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamido]-5-ethylthiophene-3-carboxylate
| Molecular Formula | C20H23N3O4S |
|---|---|
| Molecular Weight | 401.14 g/mol |
| LogP | 3.47534 |
| Topological Polar Surface Area | 96.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.14093 |
| Heavy Atoms | 28 |
| Complexity | 951.1677 |
Chemical Identifiers
| CAS Number | 1008935-78-1 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=O)CC2C(=O)NC3=C(N2)C=C(C(=C3)C)C)C(=O)OC |
Product Overview
CBKinase1_004299 (CAS 1008935-78-1), with molecular formula C20H23N3O4S and molecular weight 401.14 g/mol. IUPAC: methyl 2-[[2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetyl]amino]-5-ethylthiophene-3-carboxylate.
Chemical Property Profile of CBKinase1_004299
Property Insights of CBKinase1_004299
The XLogP value of 3.47534 indicates that CBKinase1_004299 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.53 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004299. Following Lipinski's Rule of Five, CBKinase1_004299 has 3 hydrogen bond donor(s) and 6 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_004299?
The CAS number of CBKinase1_004299 is 1008935-78-1.
What is the molecular formula of CBKinase1_004299?
The molecular formula of CBKinase1_004299 is C20H23N3O4S.
What is the molecular weight of CBKinase1_004299?
The molecular weight of CBKinase1_004299 is 401.14 g/mol.
Where can I buy CBKinase1_004299?
You can request a quote for CBKinase1_004299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004299?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.