Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid
TL;DR: Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid (CAS 3655-88-7) is a chemical compound with molecular formula C6H10N2O2S2 and molecular weight 206.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetic acid
Also Known As: Thiadiazinthion, TERRACUR, N-Methyl-tetrahydrothiamidinthione acetic acid, AI3-25778, D 3520
| Molecular Formula | C6H10N2O2S2 |
|---|---|
| Molecular Weight | 206.02 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.01837 |
| Heavy Atoms | 12 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 3655-88-7 |
|---|---|
| SMILES | CN1CN(CSC1=S)CC(=O)O |
| InChIKey | RNEWOGXVMQIGRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid (CAS 3655-88-7), with molecular formula C6H10N2O2S2 and molecular weight 206.02 g/mol. IUPAC: 2-(5-methyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetic acid.
Chemical Property Profile of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid
Property Insights of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid
The XLogP value of -1.4 indicates that Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid. Following Lipinski's Rule of Five, Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid 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 Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid?
The CAS number of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid is 3655-88-7.
What is the molecular formula of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid?
The molecular formula of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid is C6H10N2O2S2.
What is the molecular weight of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid?
The molecular weight of Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid is 206.02 g/mol.
Where can I buy Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid?
You can request a quote for Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Dihydro-5-methyl-6-thioxo-2H-1,3,5-thiadiazine-3(4H)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.