2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide
TL;DR: 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide (CAS 122772-02-5) is a chemical compound with molecular formula C12H17N3O3S and molecular weight 283.09906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(3,4-dimethoxybenzoyl)amino]-3-ethylthiourea
Also Known As: 1-[(3,4-dimethoxybenzoyl)amino]-3-ethylthiourea, 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide, 2-[(3,4-dimethoxyphenyl)carbonyl]-N-ethylhydrazinecarbothioamide, (3,4-dimethoxyphenyl)-N-{[(ethylamino)thioxomethyl]amino}carboxamide
Technical Specifications
| Molecular Formula | C12H17N3O3S |
| Molecular Weight | 283.09906 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.09906 Da |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
| SMILES | CCNC(=S)NNC(=O)C1=CC(=C(C=C1)OC)OC |
| InChIKey | QSIXENIHCHTKNV-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide
Property Insights of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide?
The CAS number of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide is 122772-02-5.
What is the molecular formula of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide?
The molecular formula of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide is C12H17N3O3S.
What is the molecular weight of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide?
The molecular weight of 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide is 283.09906 g/mol.
Where can I buy 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide?
You can request a quote for 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide?
Yes, CoreyChem provides custom synthesis services for 2-(3,4-dimethoxybenzoyl)-N-ethylhydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.