BAS 00669946
TL;DR: BAS 00669946 (CAS 34330-20-6) is a chemical compound with molecular formula C11H10N2O3S2 and molecular weight 282.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5E)-5-(1-methyl-2-pyridinylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Also Known As: BAS 00669946, (E)-2-(5-(1-methylpyridin-2(1H)-ylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetic acid, [(5E)-5-(1-methylpyridin-2(1H)-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid, [5-(1-Methyl-1H-pyridin-2-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-acetic acid, 2-[(5E)-5-(1-methylpyridin-2-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
| Molecular Formula | C11H10N2O3S2 |
|---|---|
| Molecular Weight | 282.01 g/mol |
| LogP | 1.1582 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.01328 |
| Heavy Atoms | 18 |
| Complexity | 522.38135 |
Chemical Identifiers
| CAS Number | 34330-20-6 |
|---|---|
| SMILES | CN\1C=CC=C/C1=C\2/C(=O)N(C(=S)S2)CC(=O)O |
Product Overview
BAS 00669946 (CAS 34330-20-6), with molecular formula C11H10N2O3S2 and molecular weight 282.01 g/mol. IUPAC: 2-[(5E)-5-(1-methyl-2-pyridinylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid.
Chemical Property Profile of BAS 00669946
Property Insights of BAS 00669946
The XLogP value of 1.1582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00669946. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00669946. Following Lipinski's Rule of Five, BAS 00669946 has 1 hydrogen bond donor(s) and 5 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 00669946?
The CAS number of BAS 00669946 is 34330-20-6.
What is the molecular formula of BAS 00669946?
The molecular formula of BAS 00669946 is C11H10N2O3S2.
What is the molecular weight of BAS 00669946?
The molecular weight of BAS 00669946 is 282.01 g/mol.
Where can I buy BAS 00669946?
You can request a quote for BAS 00669946 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00669946?
Yes, KEHONG BIO provides custom synthesis services for BAS 00669946 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.