BAS 13120291
TL;DR: BAS 13120291 (CAS 101290-98-6) is a chemical compound with molecular formula C16H12N2OS2 and molecular weight 312.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(6-methyl-2-pyridinyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 13120291, (5E)-5-[(6-methylpyridin-2-yl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one, 5-(6-Methyl-pyridin-2-ylmethylene)-3-phenyl-2-thioxo-thiazolidin-4-one, (5E)-5-[(6-methylpyridin-2-yl)methylidene]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one, 5-[(6-methylpyridin-2-yl)methylidene]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C16H12N2OS2 |
|---|---|
| Molecular Weight | 312.04 g/mol |
| LogP | 3.79582 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.0391 |
| Heavy Atoms | 21 |
| Complexity | 740.952 |
Chemical Identifiers
| CAS Number | 101290-98-6 |
|---|---|
| SMILES | CC1=NC(=CC=C1)/C=C/2\C(=O)N(C(=S)S2)C3=CC=CC=C3 |
Product Overview
BAS 13120291 (CAS 101290-98-6), with molecular formula C16H12N2OS2 and molecular weight 312.04 g/mol. IUPAC: (5E)-5-[(6-methyl-2-pyridinyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 13120291
Property Insights of BAS 13120291
The XLogP value of 3.79582 indicates that BAS 13120291 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.2 Ų, BAS 13120291 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 13120291 has 0 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 13120291?
The CAS number of BAS 13120291 is 101290-98-6.
What is the molecular formula of BAS 13120291?
The molecular formula of BAS 13120291 is C16H12N2OS2.
What is the molecular weight of BAS 13120291?
The molecular weight of BAS 13120291 is 312.04 g/mol.
Where can I buy BAS 13120291?
You can request a quote for BAS 13120291 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13120291?
Yes, KEHONG BIO provides custom synthesis services for BAS 13120291 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.