BAS 06976587
TL;DR: BAS 06976587 (CAS 514182-20-8) is a chemical compound with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)-N-naphthalen-1-ylacetamide
Also Known As: BAS 06976587, 2-[(2E)-3-methyl-2-(methylimino)-4-oxo-1,3-thiazolidin-5-yl]-N-(naphthalen-1-yl)acetamide, F1457-0006, 2-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)-N-naphthalen-1-ylacetamide, (E)-2-(3-methyl-2-(methylimino)-4-oxothiazolidin-5-yl)-N-(naphthalen-1-yl)acetamide
| Molecular Formula | C17H17N3O2S |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 2.728 |
| Topological Polar Surface Area | 61.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.10416 |
| Heavy Atoms | 23 |
| Complexity | 798.02997 |
Chemical Identifiers
| CAS Number | 514182-20-8 |
|---|---|
| SMILES | CN=C1N(C(=O)C(S1)CC(=O)NC2=CC=CC3=CC=CC=C32)C |
Product Overview
BAS 06976587 (CAS 514182-20-8), with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol. IUPAC: 2-(3-methyl-2-methylimino-4-oxo-1,3-thiazolidin-5-yl)-N-naphthalen-1-ylacetamide.
Chemical Property Profile of BAS 06976587
Property Insights of BAS 06976587
The XLogP value of 2.728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06976587. The TPSA of 61.77 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06976587. Following Lipinski's Rule of Five, BAS 06976587 has 1 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 BAS 06976587?
The CAS number of BAS 06976587 is 514182-20-8.
What is the molecular formula of BAS 06976587?
The molecular formula of BAS 06976587 is C17H17N3O2S.
What is the molecular weight of BAS 06976587?
The molecular weight of BAS 06976587 is 327.10 g/mol.
Where can I buy BAS 06976587?
You can request a quote for BAS 06976587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06976587?
Yes, KEHONG BIO provides custom synthesis services for BAS 06976587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.