2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide
TL;DR: 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide (CAS 292644-13-4) is a chemical compound with molecular formula C16H17N3OS2 and molecular weight 331.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-benzylsulfanylacetyl)amino]-3-phenylthiourea
Also Known As: 2-((BENZYLTHIO)ACETYL)-N-PHENYLHYDRAZINECARBOTHIOAMIDE, 1-[(2-benzylsulfanylacetyl)amino]-3-phenylthiourea, N-{[(phenylamino)thioxomethyl]amino}-2-(phenylmethylthio)acetamide, 657-268-2, RefChem:449805
| Molecular Formula | C16H17N3OS2 |
|---|---|
| Molecular Weight | 331.08 g/mol |
| LogP | 2.9376 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.0813 |
| Heavy Atoms | 22 |
| Complexity | 605.3027 |
Chemical Identifiers
| CAS Number | 292644-13-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSCC(=O)NNC(=S)NC2=CC=CC=C2 |
Product Overview
2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide (CAS 292644-13-4), with molecular formula C16H17N3OS2 and molecular weight 331.08 g/mol. IUPAC: 1-[(2-benzylsulfanylacetyl)amino]-3-phenylthiourea.
Chemical Property Profile of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide
Property Insights of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide
The XLogP value of 2.9376 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide. With a topological polar surface area (TPSA) of 53.16 Ų, 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide 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-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide?
The CAS number of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide is 292644-13-4.
What is the molecular formula of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide?
The molecular formula of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide is C16H17N3OS2.
What is the molecular weight of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide?
The molecular weight of 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide is 331.08 g/mol.
Where can I buy 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide?
You can request a quote for 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((Benzylthio)acetyl)-N-phenylhydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.