Methyl 4-morpholinylcarbothioylcarbamate
TL;DR: Methyl 4-morpholinylcarbothioylcarbamate (CAS 126651-67-0) is a chemical compound with molecular formula C7H12N2O3S and molecular weight 204.05687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-(morpholine-4-carbothioyl)carbamate
Also Known As: methyl 4-morpholinylcarbothioylcarbamate, Methyl morpholine-4-carbonothioylcarbamate, methyl N-(morpholine-4-carbothioyl)carbamate, AB-601/30963030, 663-737-2
Technical Specifications
| Molecular Formula | C7H12N2O3S |
| Molecular Weight | 204.05687 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 82.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.05687 Da |
| Heavy Atoms | 13 |
| Complexity | 204.0 |
| SMILES | COC(=O)NC(=S)N1CCOCC1 |
| InChIKey | YGHZWZGKSAPRDM-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-morpholinylcarbothioylcarbamate
Property Insights of Methyl 4-morpholinylcarbothioylcarbamate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-morpholinylcarbothioylcarbamate. The TPSA of 82.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-morpholinylcarbothioylcarbamate. Following Lipinski's Rule of Five, Methyl 4-morpholinylcarbothioylcarbamate 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
What is the CAS number of Methyl 4-morpholinylcarbothioylcarbamate?
The CAS number of Methyl 4-morpholinylcarbothioylcarbamate is 126651-67-0.
What is the molecular formula of Methyl 4-morpholinylcarbothioylcarbamate?
The molecular formula of Methyl 4-morpholinylcarbothioylcarbamate is C7H12N2O3S.
What is the molecular weight of Methyl 4-morpholinylcarbothioylcarbamate?
The molecular weight of Methyl 4-morpholinylcarbothioylcarbamate is 204.05687 g/mol.
Where can I buy Methyl 4-morpholinylcarbothioylcarbamate?
You can request a quote for Methyl 4-morpholinylcarbothioylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-morpholinylcarbothioylcarbamate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-morpholinylcarbothioylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.