N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine
TL;DR: N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine (CAS 76312-36-2) is a chemical compound with molecular formula C13H17NO3S and molecular weight 267.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine
Also Known As: N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine, N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-ami, 4-(Dimethylamino)-5-methyl-6-phenyl-3,4-dihydro-2H-1,2lambda~6~-oxathiine-2,2-dione
| Molecular Formula | C13H17NO3S |
|---|---|
| Molecular Weight | 267.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.09293 |
| Heavy Atoms | 18 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 76312-36-2 |
|---|---|
| SMILES | CC1=C(OS(=O)(=O)CC1N(C)C)C2=CC=CC=C2 |
| InChIKey | GWTIZKMKCVCGOF-UHFFFAOYSA-N |
Product Overview
N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine (CAS 76312-36-2), with molecular formula C13H17NO3S and molecular weight 267.09 g/mol. IUPAC: N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine.
Chemical Property Profile of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine
Property Insights of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine. With a topological polar surface area (TPSA) of 55.0 Ų, N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine 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 N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine?
The CAS number of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine is 76312-36-2.
What is the molecular formula of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine?
The molecular formula of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine is C13H17NO3S.
What is the molecular weight of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine?
The molecular weight of N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine is 267.09 g/mol.
Where can I buy N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine?
You can request a quote for N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N,N,5-trimethyl-2,2-dioxo-6-phenyl-3,4-dihydrooxathiin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.