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[(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
TL;DR: [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate (CAS 59375-71-2) is a chemical compound with molecular formula C7H12N2O2S2 and molecular weight 220.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
Also Known As: [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate|3-Methyl-1,4-dithian-2-one O-((methylamino)carbonyl)oxime
| Molecular Formula | C7H12N2O2S2 |
|---|---|
| Molecular Weight | 220.03 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.03403 |
| Heavy Atoms | 13 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 59375-71-2 |
|---|---|
| SMILES | CC1C(=NOC(=O)NC)SCCS1 |
| InChIKey | UNTSPMCSYMCSNZ-UHFFFAOYSA-N |
Product Overview
[(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate (CAS 59375-71-2), with molecular formula C7H12N2O2S2 and molecular weight 220.03 g/mol. IUPAC: [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate.
Chemical Property Profile of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
Property Insights of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate. Following Lipinski's Rule of Five, [(3-methyl-1,4-dithian-2-ylidene)amino] 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 [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate?
The CAS number of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate is 59375-71-2.
What is the molecular formula of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate?
The molecular formula of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate is C7H12N2O2S2.
What is the molecular weight of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate?
The molecular weight of [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate is 220.03 g/mol.
Where can I buy [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate?
You can request a quote for [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [(3-methyl-1,4-dithian-2-ylidene)amino] N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.