Rhodanine, 3-benzyl-5-methyl-
TL;DR: Rhodanine, 3-benzyl-5-methyl- (CAS 24591-49-9) is a chemical compound with molecular formula C11H11NOS2 and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-Benzyl-5-methylrhodanine, Rhodanine, 3-benzyl-5-methyl-, 3-benzyl-5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one, 3-benzyl-5-methyl-2-thioxo-1,3-thiazolidin-4-one, 2-Thioxo-3-benzyl-5-methylthiazolidin-4-one
| Molecular Formula | C11H11NOS2 |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.02821 |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 24591-49-9 |
|---|---|
| SMILES | CC1C(=O)N(C(=S)S1)CC2=CC=CC=C2 |
| InChIKey | ZOMAEZIFFMSAHO-UHFFFAOYSA-N |
Product Overview
Rhodanine, 3-benzyl-5-methyl- (CAS 24591-49-9), with molecular formula C11H11NOS2 and molecular weight 237.03 g/mol. IUPAC: 3-benzyl-5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of Rhodanine, 3-benzyl-5-methyl-
Property Insights of Rhodanine, 3-benzyl-5-methyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rhodanine, 3-benzyl-5-methyl-. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Rhodanine, 3-benzyl-5-methyl-. Following Lipinski's Rule of Five, Rhodanine, 3-benzyl-5-methyl- has 0 hydrogen bond donor(s) and 3 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 Rhodanine, 3-benzyl-5-methyl-?
The CAS number of Rhodanine, 3-benzyl-5-methyl- is 24591-49-9.
What is the molecular formula of Rhodanine, 3-benzyl-5-methyl-?
The molecular formula of Rhodanine, 3-benzyl-5-methyl- is C11H11NOS2.
What is the molecular weight of Rhodanine, 3-benzyl-5-methyl-?
The molecular weight of Rhodanine, 3-benzyl-5-methyl- is 237.03 g/mol.
Where can I buy Rhodanine, 3-benzyl-5-methyl-?
You can request a quote for Rhodanine, 3-benzyl-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rhodanine, 3-benzyl-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Rhodanine, 3-benzyl-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.