BAS 04357893
TL;DR: BAS 04357893 (CAS 1164483-76-4) is a chemical compound with molecular formula C16H18N4O2S2 and molecular weight 362.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)acetamide
Also Known As: BAS 04357893, AS-871/40976352, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)acetamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(2E)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide, N-(3-Cyano-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-2-{3-methyl-2-[(Z)-methylimino]-4-oxo-thiazolidin-5-yl}-acetamide
| Molecular Formula | C16H18N4O2S2 |
|---|---|
| Molecular Weight | 362.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.08713 |
| Heavy Atoms | 24 |
| Complexity | 614.0 |
Chemical Identifiers
| CAS Number | 1164483-76-4 |
|---|---|
| SMILES | CN=C1N(C(=O)C(S1)CC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C |
| InChIKey | GZDXQLGJOMHQAV-UHFFFAOYSA-N |
Product Overview
BAS 04357893 (CAS 1164483-76-4), with molecular formula C16H18N4O2S2 and molecular weight 362.09 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)acetamide.
Chemical Property Profile of BAS 04357893
Property Insights of BAS 04357893
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04357893. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04357893. Following Lipinski's Rule of Five, BAS 04357893 has 1 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 BAS 04357893?
The CAS number of BAS 04357893 is 1164483-76-4.
What is the molecular formula of BAS 04357893?
The molecular formula of BAS 04357893 is C16H18N4O2S2.
What is the molecular weight of BAS 04357893?
The molecular weight of BAS 04357893 is 362.09 g/mol.
Where can I buy BAS 04357893?
You can request a quote for BAS 04357893 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04357893?
Yes, KEHONG BIO provides custom synthesis services for BAS 04357893 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.