Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-
TL;DR: Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- (CAS 29053-47-2) is a chemical compound with molecular formula C9H20N2S2 and molecular weight 220.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl-ethylcarbamodithioic acid
Also Known As: (2-(Diethylaminoethyl)ethyl)dithiocarbamic acid, Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-, 4-04-00-01229 (Beilstein Handbook Reference), 2-diethylaminoethyl(ethyl)carbamodithioic acid, 2-(diethylamino)ethyl-ethylcarbamodithioic acid
| Molecular Formula | C9H20N2S2 |
|---|---|
| Molecular Weight | 220.11 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 39.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 220.1068 |
| Heavy Atoms | 13 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 29053-47-2 |
|---|---|
| SMILES | CCN(CC)CCN(CC)C(=S)S |
| InChIKey | ZOKTYMFJIUHLPC-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- (CAS 29053-47-2), with molecular formula C9H20N2S2 and molecular weight 220.11 g/mol. IUPAC: 2-(diethylamino)ethyl-ethylcarbamodithioic acid.
Chemical Property Profile of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-
Property Insights of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-. With a topological polar surface area (TPSA) of 39.6 Ų, Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- has 1 hydrogen bond donor(s) and 3 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 Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-?
The CAS number of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- is 29053-47-2.
What is the molecular formula of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-?
The molecular formula of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- is C9H20N2S2.
What is the molecular weight of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-?
The molecular weight of Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- is 220.11 g/mol.
Where can I buy Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-?
You can request a quote for Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio-?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (2-(diethylaminoethyl)ethyl)dithio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.