![2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate structure](/static/products/916/91695-66-8.png)
2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate
TL;DR: 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate (CAS 91695-66-8) is a chemical compound with molecular formula C12H22N2OS2 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(prop-2-enyl)amino]ethyl N-(2-methoxyethyl)carbamodithioate
Also Known As: Carbamodithioic acid, 2-(di-2-propenylamino)ethyl ester, 2-[bis(prop-2-enyl)amino]ethyl N-(2-methoxyethyl)carbamodithioate, 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate
| Molecular Formula | C12H22N2OS2 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 1.9145 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 274.11737 |
| Heavy Atoms | 17 |
| Complexity | 224.54552 |
Chemical Identifiers
| CAS Number | 91695-66-8 |
|---|---|
| SMILES | COCCNC(=S)SCCN(CC=C)CC=C |
Product Overview
2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate (CAS 91695-66-8), with molecular formula C12H22N2OS2 and molecular weight 274.12 g/mol. IUPAC: 2-[bis(prop-2-enyl)amino]ethyl N-(2-methoxyethyl)carbamodithioate.
Chemical Property Profile of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate
Property Insights of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate
The XLogP value of 1.9145 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate. With a topological polar surface area (TPSA) of 24.5 Ų, 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate 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
Frequently Asked Questions
What is the CAS number of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate?
The CAS number of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate is 91695-66-8.
What is the molecular formula of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate?
The molecular formula of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate is C12H22N2OS2.
What is the molecular weight of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate?
The molecular weight of 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate is 274.12 g/mol.
Where can I buy 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate?
You can request a quote for 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for 2-[Di(prop-2-en-1-yl)amino]ethyl (2-methoxyethyl)carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.