![[(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate structure](/static/products/3316/33160-78-0.webp)
[(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate
TL;DR: [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate (CAS 33160-78-0) is a chemical compound with molecular formula C9H16N2O2S2 and molecular weight 248.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate
Also Known As: 1,3-Dithiolane-2-carboxaldehyde, 2,4,5-trimethyl-, O-(methylcarbamoyl)oxime
| Molecular Formula | C9H16N2O2S2 |
|---|---|
| Molecular Weight | 248.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.06532 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 33160-78-0 |
|---|---|
| SMILES | CC1C(SC(S1)(C)C=NOC(=O)NC)C |
| InChIKey | NWBLSYWXGOQPQX-UHFFFAOYSA-N |
Product Overview
[(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate (CAS 33160-78-0), with molecular formula C9H16N2O2S2 and molecular weight 248.07 g/mol. IUPAC: [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate.
Chemical Property Profile of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate
Property Insights of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate. Following Lipinski's Rule of Five, [(2,4,5-trimethyl-1,3-dithiolan-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 [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate?
The CAS number of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate is 33160-78-0.
What is the molecular formula of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate?
The molecular formula of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate is C9H16N2O2S2.
What is the molecular weight of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate?
The molecular weight of [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate is 248.07 g/mol.
Where can I buy [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate?
You can request a quote for [(2,4,5-trimethyl-1,3-dithiolan-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 [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [(2,4,5-trimethyl-1,3-dithiolan-2-yl)methylideneamino] N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.