![2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide structure](/static/products/155/155820-95-4.webp)
2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide
TL;DR: 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide (CAS 155820-95-4) is a chemical compound with molecular formula C12H14N4OS3 and molecular weight 326.033 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-3-ethylthiourea
Also Known As: BAS 00588770, 1-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-3-ethylthiourea, 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide, 2-(2-(benzo[d]thiazol-2-ylthio)acetyl)-N-ethylhydrazinecarbothioamide, 2-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N-ethylhydrazinecarbothioamide
Technical Specifications
| Molecular Formula | C12H14N4OS3 |
| Molecular Weight | 326.033 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 152.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.033 Da |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
| SMILES | CCNC(=S)NNC(=O)CSC1=NC2=CC=CC=C2S1 |
| InChIKey | KZNKCBQUDSFITJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide
Property Insights of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide. The TPSA of 152.0 Ų indicates high polarity, suggesting 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide has 3 hydrogen bond donor(s) and 5 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-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide?
The CAS number of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide is 155820-95-4.
What is the molecular formula of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide?
The molecular formula of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide is C12H14N4OS3.
What is the molecular weight of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide?
The molecular weight of 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide is 326.033 g/mol.
Where can I buy 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide?
You can request a quote for 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide?
Yes, CoreyChem provides custom synthesis services for 2-benzothiazol-2-ylthio-N-{[(ethylamino)thioxomethyl]amino}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.