Carbamimidothioic acid, 2-(dimethylamino)ethyl ester
TL;DR: Carbamimidothioic acid, 2-(dimethylamino)ethyl ester (CAS 17124-82-2) is a chemical compound with molecular formula C5H13N3S and molecular weight 147.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl carbamimidothioate
Also Known As: Nordimaprit, starbld0005051, 2-(S-Dimethylaminoethyl)isothiourea, 2-(2-Dimethylaminoethyl)isothiourea, 2-(dimethylamino)ethyl carbamimidothioate
| Molecular Formula | C5H13N3S |
|---|---|
| Molecular Weight | 147.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 147.08302 |
| Heavy Atoms | 9 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 17124-82-2 |
|---|---|
| SMILES | CN(C)CCSC(=N)N |
| InChIKey | MUYRPUKYVOXLSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamimidothioic acid, 2-(dimethylamino)ethyl ester (CAS 17124-82-2), with molecular formula C5H13N3S and molecular weight 147.08 g/mol. IUPAC: 2-(dimethylamino)ethyl carbamimidothioate.
Chemical Property Profile of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester
Property Insights of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamimidothioic acid, 2-(dimethylamino)ethyl ester. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamimidothioic acid, 2-(dimethylamino)ethyl ester. Following Lipinski's Rule of Five, Carbamimidothioic acid, 2-(dimethylamino)ethyl ester 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 Carbamimidothioic acid, 2-(dimethylamino)ethyl ester?
The CAS number of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester is 17124-82-2.
What is the molecular formula of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester?
The molecular formula of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester is C5H13N3S.
What is the molecular weight of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester?
The molecular weight of Carbamimidothioic acid, 2-(dimethylamino)ethyl ester is 147.08 g/mol.
Where can I buy Carbamimidothioic acid, 2-(dimethylamino)ethyl ester?
You can request a quote for Carbamimidothioic acid, 2-(dimethylamino)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamimidothioic acid, 2-(dimethylamino)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamimidothioic acid, 2-(dimethylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.