2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide
TL;DR: 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide (CAS 409357-96-6) is a chemical compound with molecular formula C13H13N3O2S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzofuran-2-carbonylamino)-3-prop-2-enylthiourea
Also Known As: BAS 02913222, 1-(1-benzofuran-2-carbonylamino)-3-prop-2-enylthiourea, N-allyl-2-(benzofuran-2-carbonyl)hydrazinecarbothioamide, 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide
| Molecular Formula | C13H13N3O2S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 1.7277 |
| Topological Polar Surface Area | 66.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.07285 |
| Heavy Atoms | 19 |
| Complexity | 588.1308 |
Chemical Identifiers
| CAS Number | 409357-96-6 |
|---|---|
| SMILES | C=CCNC(=S)NNC(=O)C1=CC2=CC=CC=C2O1 |
Product Overview
2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide (CAS 409357-96-6), with molecular formula C13H13N3O2S and molecular weight 275.07 g/mol. IUPAC: 1-(1-benzofuran-2-carbonylamino)-3-prop-2-enylthiourea.
Chemical Property Profile of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Property Insights of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide
The XLogP value of 1.7277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide has 3 hydrogen bond donor(s) and 3 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-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide?
The CAS number of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide is 409357-96-6.
What is the molecular formula of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide?
The molecular formula of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide is C13H13N3O2S.
What is the molecular weight of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide?
The molecular weight of 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide is 275.07 g/mol.
Where can I buy 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide?
You can request a quote for 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-benzofuran-2-ylcarbonyl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.