methyl N-(2,2-diphenylethenylsulfonyl)carbamate
TL;DR: methyl N-(2,2-diphenylethenylsulfonyl)carbamate (CAS 53285-94-2) is a chemical compound with molecular formula C16H15NO4S and molecular weight 317.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(2,2-diphenylethenylsulfonyl)carbamate
Also Known As: methyl N-(2,2-diphenylethenylsulfonyl)carbamate, Methyl (2,2-diphenylethene-1-sulfonyl)carbamate, Acetic acid, ((7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-6-yl)oxy)-, monosodium salt, RefChem:356725
| Molecular Formula | C16H15NO4S |
|---|---|
| Molecular Weight | 317.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.07217 |
| Heavy Atoms | 22 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 53285-94-2 |
|---|---|
| SMILES | COC(=O)NS(=O)(=O)C=C(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | KERAEGWKOAUFRT-UHFFFAOYSA-N |
Product Overview
methyl N-(2,2-diphenylethenylsulfonyl)carbamate (CAS 53285-94-2), with molecular formula C16H15NO4S and molecular weight 317.07 g/mol. IUPAC: methyl N-(2,2-diphenylethenylsulfonyl)carbamate.
Chemical Property Profile of methyl N-(2,2-diphenylethenylsulfonyl)carbamate
Property Insights of methyl N-(2,2-diphenylethenylsulfonyl)carbamate
The XLogP value of 3.4 indicates that methyl N-(2,2-diphenylethenylsulfonyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-(2,2-diphenylethenylsulfonyl)carbamate. Following Lipinski's Rule of Five, methyl N-(2,2-diphenylethenylsulfonyl)carbamate has 1 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 methyl N-(2,2-diphenylethenylsulfonyl)carbamate?
The CAS number of methyl N-(2,2-diphenylethenylsulfonyl)carbamate is 53285-94-2.
What is the molecular formula of methyl N-(2,2-diphenylethenylsulfonyl)carbamate?
The molecular formula of methyl N-(2,2-diphenylethenylsulfonyl)carbamate is C16H15NO4S.
What is the molecular weight of methyl N-(2,2-diphenylethenylsulfonyl)carbamate?
The molecular weight of methyl N-(2,2-diphenylethenylsulfonyl)carbamate is 317.07 g/mol.
Where can I buy methyl N-(2,2-diphenylethenylsulfonyl)carbamate?
You can request a quote for methyl N-(2,2-diphenylethenylsulfonyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-(2,2-diphenylethenylsulfonyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-(2,2-diphenylethenylsulfonyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.