2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate
TL;DR: 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate (CAS 247070-08-2) is a chemical compound with molecular formula C15H19NO5S and molecular weight 325.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-tert-butyl-4-oxochromen-6-yl) N,N-dimethylsulfamate
Also Known As: 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate, 6-(dimethylsulfamoyloxy)-4-oxo-2-tert-butyl-chromene
| Molecular Formula | C15H19NO5S |
|---|---|
| Molecular Weight | 325.10 g/mol |
| LogP | 2.2757 |
| Topological Polar Surface Area | 76.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.0984 |
| Heavy Atoms | 22 |
| Complexity | 859.6123 |
Chemical Identifiers
| CAS Number | 247070-08-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=O)C2=C(O1)C=CC(=C2)OS(=O)(=O)N(C)C |
Product Overview
2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate (CAS 247070-08-2), with molecular formula C15H19NO5S and molecular weight 325.10 g/mol. IUPAC: (2-tert-butyl-4-oxochromen-6-yl) N,N-dimethylsulfamate.
Chemical Property Profile of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate
Property Insights of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate
The XLogP value of 2.2757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate. The TPSA of 76.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate. Following Lipinski's Rule of Five, 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate has 0 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 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate?
The CAS number of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate is 247070-08-2.
What is the molecular formula of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate?
The molecular formula of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate is C15H19NO5S.
What is the molecular weight of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate?
The molecular weight of 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate is 325.10 g/mol.
Where can I buy 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate?
You can request a quote for 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-butyl-4-oxo-4H-chromen-6-yl dimethylsulfamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.