2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide
TL;DR: 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide (CAS 315211-13-3) is a chemical compound with molecular formula C11H14N6OS and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-ethylthiourea
Also Known As: 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide, 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-ethylthiourea, AO-476/40494746
| Molecular Formula | C11H14N6OS |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | -0.0535 |
| Topological Polar Surface Area | 83.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.09497 |
| Heavy Atoms | 19 |
| Complexity | 595.6379 |
Chemical Identifiers
| CAS Number | 315211-13-3 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)CN1C2=CC=CC=C2N=N1 |
Product Overview
2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide (CAS 315211-13-3), with molecular formula C11H14N6OS and molecular weight 278.09 g/mol. IUPAC: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-ethylthiourea.
Chemical Property Profile of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide
Property Insights of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide
The XLogP value of -0.0535 indicates that 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-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
Frequently Asked Questions
What is the CAS number of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide?
The CAS number of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide is 315211-13-3.
What is the molecular formula of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide?
The molecular formula of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide is C11H14N6OS.
What is the molecular weight of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide?
The molecular weight of 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide is 278.09 g/mol.
Where can I buy 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide?
You can request a quote for 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-1,2,3-benzotriazol-1-ylacetyl)-N-ethylhydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.