C12H10BrNO3S2
TL;DR: C12H10BrNO3S2 (CAS 326019-49-2) is a chemical compound with molecular formula C12H10BrNO3S2 and molecular weight 358.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CHEMBRDG-BB 5602641, BAS 00365488, (5E)-5-(5-bromo-2-hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxo-1,3-thiazolidin-4-one, 5-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one, (E)-5-(5-Bromo-2-hydroxy-3-methoxybenzylidene)-3-methyl-2-thioxothiazolidin-4-one
| Molecular Formula | C12H10BrNO3S2 |
|---|---|
| Molecular Weight | 358.93 g/mol |
| LogP | 2.9943 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.92856 |
| Heavy Atoms | 19 |
| Complexity | 600.88245 |
Chemical Identifiers
| CAS Number | 326019-49-2 |
|---|---|
| SMILES | CN1C(=O)C(=CC2=C(C(=CC(=C2)Br)OC)O)SC1=S |
Product Overview
C12H10BrNO3S2 (CAS 326019-49-2), with molecular formula C12H10BrNO3S2 and molecular weight 358.93 g/mol. IUPAC: 5-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of C12H10BrNO3S2
Property Insights of C12H10BrNO3S2
The XLogP value of 2.9943 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C12H10BrNO3S2. With a topological polar surface area (TPSA) of 49.77 Ų, C12H10BrNO3S2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C12H10BrNO3S2 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 C12H10BrNO3S2?
The CAS number of C12H10BrNO3S2 is 326019-49-2.
What is the molecular formula of C12H10BrNO3S2?
The molecular formula of C12H10BrNO3S2 is C12H10BrNO3S2.
What is the molecular weight of C12H10BrNO3S2?
The molecular weight of C12H10BrNO3S2 is 358.93 g/mol.
Where can I buy C12H10BrNO3S2?
You can request a quote for C12H10BrNO3S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C12H10BrNO3S2?
Yes, KEHONG BIO provides custom synthesis services for C12H10BrNO3S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.