Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide
TL;DR: Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide (CAS 93113-98-5) is a chemical compound with molecular formula C5H13BrN2S2 and molecular weight 243.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethyl N,N-dimethylcarbamodithioate;hydrobromide
Also Known As: Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide, 2-aminoethyl N,N-dimethylcarbamodithioate hydrobromide, 2-aminoethyl N,N-dimethylcarbamodithioate,hydrobromide, 2-Aminoethyl dimethylcarbamodithioate--hydrogen bromide (1/1)
| Molecular Formula | C5H13BrN2S2 |
|---|---|
| Molecular Weight | 243.97 g/mol |
| LogP | 1.1027 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.97035 |
| Heavy Atoms | 10 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 93113-98-5 |
|---|---|
| SMILES | CN(C)C(=S)SCCN.Br |
| InChIKey | XSRWTCLEIKCKIY-UHFFFAOYSA-N |
Product Overview
Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide (CAS 93113-98-5), with molecular formula C5H13BrN2S2 and molecular weight 243.97 g/mol. IUPAC: 2-aminoethyl N,N-dimethylcarbamodithioate;hydrobromide.
Chemical Property Profile of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide
Property Insights of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide
The XLogP value of 1.1027 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide. Following Lipinski's Rule of Five, Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide has 2 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, dimethyldithio-, 2-aminoethyl ester, hydrobromide?
The CAS number of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide is 93113-98-5.
What is the molecular formula of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide?
The molecular formula of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide is C5H13BrN2S2.
What is the molecular weight of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide?
The molecular weight of Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide is 243.97 g/mol.
Where can I buy Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide?
You can request a quote for Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, dimethyldithio-, 2-aminoethyl ester, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.