3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide
TL;DR: 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide (CAS 7157-91-7) is a chemical compound with molecular formula C7H9N3OS2 and molecular weight 215.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-prop-2-enyl-2-sulfanylidene-1,3-thiazole-5-carboxamide
Also Known As: 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide, 3-Allyl-4-amino-2-thioxo-2,3-dihydrothiazole-5-carboxamide, ZERO/001902, SALOR-INT L252425-1EA, 4-amino-3-(prop-2-en-1-yl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
| Molecular Formula | C7H9N3OS2 |
|---|---|
| Molecular Weight | 215.02 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.0187 |
| Heavy Atoms | 13 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 7157-91-7 |
|---|---|
| SMILES | C=CCN1C(=C(SC1=S)C(=O)N)N |
| InChIKey | RCNAPOFQSALVID-UHFFFAOYSA-N |
Product Overview
3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide (CAS 7157-91-7), with molecular formula C7H9N3OS2 and molecular weight 215.02 g/mol. IUPAC: 4-amino-3-prop-2-enyl-2-sulfanylidene-1,3-thiazole-5-carboxamide.
Chemical Property Profile of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide
Property Insights of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide. Following Lipinski's Rule of Five, 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide has 2 hydrogen bond donor(s) and 4 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 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide?
The CAS number of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide is 7157-91-7.
What is the molecular formula of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide?
The molecular formula of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide is C7H9N3OS2.
What is the molecular weight of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide?
The molecular weight of 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide is 215.02 g/mol.
Where can I buy 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide?
You can request a quote for 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide?
Yes, KEHONG BIO provides custom synthesis services for 3-Allyl-4-amino-2-thioxo-2,3-dihydro-thiazole-5-carboxylic acid amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.