2-(Phenoxyacetyl)hydrazinecarbothioamide
TL;DR: 2-(Phenoxyacetyl)hydrazinecarbothioamide (CAS 35687-21-9) is a chemical compound with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-phenoxyacetyl)amino]thiourea
Also Known As: [(2-phenoxyacetyl)amino]thiourea, N-phenoxyacetyl-N'-thiocarbamoyl-hydrazine, 2-(phenoxyacetyl)hydrazinecarbothioamide, BIM-0020256.P001, AB00084184-01
| Molecular Formula | C9H11N3O2S |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.0572 |
| Heavy Atoms | 15 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 35687-21-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCC(=O)NNC(=S)N |
| InChIKey | LCJZPHKZSTWNQU-UHFFFAOYSA-N |
Product Overview
2-(Phenoxyacetyl)hydrazinecarbothioamide (CAS 35687-21-9), with molecular formula C9H11N3O2S and molecular weight 225.06 g/mol. IUPAC: [(2-phenoxyacetyl)amino]thiourea.
Chemical Property Profile of 2-(Phenoxyacetyl)hydrazinecarbothioamide
Property Insights of 2-(Phenoxyacetyl)hydrazinecarbothioamide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Phenoxyacetyl)hydrazinecarbothioamide. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Phenoxyacetyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(Phenoxyacetyl)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-(Phenoxyacetyl)hydrazinecarbothioamide?
The CAS number of 2-(Phenoxyacetyl)hydrazinecarbothioamide is 35687-21-9.
What is the molecular formula of 2-(Phenoxyacetyl)hydrazinecarbothioamide?
The molecular formula of 2-(Phenoxyacetyl)hydrazinecarbothioamide is C9H11N3O2S.
What is the molecular weight of 2-(Phenoxyacetyl)hydrazinecarbothioamide?
The molecular weight of 2-(Phenoxyacetyl)hydrazinecarbothioamide is 225.06 g/mol.
Where can I buy 2-(Phenoxyacetyl)hydrazinecarbothioamide?
You can request a quote for 2-(Phenoxyacetyl)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Phenoxyacetyl)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Phenoxyacetyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.