[1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon
TL;DR: [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon (CAS 70889-26-8) is a chemical compound with molecular formula C19H25N3O6S and molecular weight 423.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methyl N-methylcarbamate
Also Known As: [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon|[1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methyl N-methylcarbamate|1H-Pyrrole-3, 1,2-dimethyl-5-[4-(methylsulfonyl)phenyl]-, bis(methylcarbamate) (ester)|{2-[4-(Methanesulfonyl)phenyl]-1,5-dimethyl-1H-pyrrole-3,4-diyl}bis(methylene) bis(methylcarbamate)
| Molecular Formula | C19H25N3O6S |
|---|---|
| Molecular Weight | 423.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.1464 |
| Heavy Atoms | 29 |
| Complexity | 672.0 |
Chemical Identifiers
| CAS Number | 70889-26-8 |
|---|---|
| SMILES | CC1=C(C(=C(N1C)C2=CC=C(C=C2)S(=O)(=O)C)COC(=O)NC)COC(=O)NC |
| InChIKey | GZMQRXUJRMJUAZ-UHFFFAOYSA-N |
Product Overview
[1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon (CAS 70889-26-8), with molecular formula C19H25N3O6S and molecular weight 423.15 g/mol. IUPAC: [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfonylphenyl)pyrrol-3-yl]methyl N-methylcarbamate.
Chemical Property Profile of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon
Property Insights of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon. Following Lipinski's Rule of Five, [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon has 2 hydrogen bond donor(s) and 6 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 [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon?
The CAS number of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon is 70889-26-8.
What is the molecular formula of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon?
The molecular formula of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon is C19H25N3O6S.
What is the molecular weight of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon?
The molecular weight of [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon is 423.15 g/mol.
Where can I buy [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon?
You can request a quote for [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon?
Yes, KEHONG BIO provides custom synthesis services for [1,2-dimethyl-4-(methylcarbamoyloxymethyl)-5-(4-methylsulfon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.