![[(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate structure](/static/products/2641/26419-72-7.webp)
[(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate
TL;DR: [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate (CAS 26419-72-7) is a chemical compound with molecular formula C8H14N2O2S2 and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate
Also Known As: AI3-27903, AI 3-27903, 2-Methyl-m-dithiane-2-carboxaldehyde O-(methylcarbamoyl)oxime, 1,3-Dithiane-2-carboxaldehyde,2-methyl-, O-[(methylamino)carbonyl]oxime (9CI)
| Molecular Formula | C8H14N2O2S2 |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.04967 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 26419-72-7 |
|---|---|
| SMILES | CC1(SCCCS1)C=NOC(=O)NC |
| InChIKey | YRROZKZBFAEWIZ-UHFFFAOYSA-N |
Product Overview
[(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate (CAS 26419-72-7), with molecular formula C8H14N2O2S2 and molecular weight 234.05 g/mol. IUPAC: [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate.
Chemical Property Profile of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate
Property Insights of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate. Following Lipinski's Rule of Five, [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate has 1 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-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate?
The CAS number of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate is 26419-72-7.
What is the molecular formula of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate?
The molecular formula of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate is C8H14N2O2S2.
What is the molecular weight of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate?
The molecular weight of [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate is 234.05 g/mol.
Where can I buy [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate?
You can request a quote for [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [(2-methyl-1,3-dithian-2-yl)methylideneamino] N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.