N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide
TL;DR: N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide (CAS 328069-48-3) is a chemical compound with molecular formula C6H8N2O3S and molecular weight 188.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-carbamothioyl-2,3-dihydro-1,4-dioxine-5-carboxamide
Also Known As: N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide, N-carbamothioyl-2,3-dihydro-1,4-dioxine-5-carboxamide
| Molecular Formula | C6H8N2O3S |
|---|---|
| Molecular Weight | 188.03 g/mol |
| LogP | -0.7656 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.02556 |
| Heavy Atoms | 12 |
| Complexity | 238.9477 |
Chemical Identifiers
| CAS Number | 328069-48-3 |
|---|---|
| SMILES | C1COC(=CO1)C(=O)NC(=S)N |
Product Overview
N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide (CAS 328069-48-3), with molecular formula C6H8N2O3S and molecular weight 188.03 g/mol. IUPAC: N-carbamothioyl-2,3-dihydro-1,4-dioxine-5-carboxamide.
Chemical Property Profile of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide
Property Insights of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide
The XLogP value of -0.7656 indicates that N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide. Following Lipinski's Rule of Five, N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide has 2 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 N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide?
The CAS number of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide is 328069-48-3.
What is the molecular formula of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide?
The molecular formula of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide is C6H8N2O3S.
What is the molecular weight of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide?
The molecular weight of N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide is 188.03 g/mol.
Where can I buy N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide?
You can request a quote for N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-carbamothioyl-5,6-dihydro-1,4-dioxine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.