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Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)
TL;DR: Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) (CAS 160996-10-1) is a chemical compound with molecular formula C5H12N2OS and molecular weight 148.06703 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(dimethylamino)ethylcarbamothioic S-acid
Also Known As: 2-dimethylaminoethylcarbamothioic S-acid, 2-(dimethylamino)ethylcarbamothioic S-acid, (2-dimethylaminoethylamino)methanethioic Acid, Carbamothioic acid, [2-(dimethylamino)ethyl]- (9CI)
Technical Specifications
| Molecular Formula | C5H12N2OS |
| Molecular Weight | 148.06703 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 33.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.06703 Da |
| Heavy Atoms | 9 |
| Complexity | 95.0 |
| SMILES | CN(C)CCNC(=O)S |
| InChIKey | VEQOTPTUWJPAAU-UHFFFAOYSA-N |
Chemical Property Profile of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)
Property Insights of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI). With a topological polar surface area (TPSA) of 33.3 Ų, Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) 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
What is the CAS number of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)?
The CAS number of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) is 160996-10-1.
What is the molecular formula of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)?
The molecular formula of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) is C5H12N2OS.
What is the molecular weight of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)?
The molecular weight of Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) is 148.06703 g/mol.
Where can I buy Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)?
You can request a quote for Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI)?
Yes, CoreyChem provides custom synthesis services for Carbamothioic acid, [2-(dimethylamino)ethyl]-(9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.