Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester
TL;DR: Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester (CAS 112766-44-6) is a chemical compound with molecular formula C8H11N3S and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-amino-N'-phenylcarbamimidothioate
Also Known As: methyl N-amino-N'-phenylcarbamimidothioate, methyl N-phenylhydrazinecarbimidothioate, Methyl N-phenylhydrazinecarboximidothioate, Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester, N-amino-1-methylsulfanyl-N'-phenyl-methanimidamide
| Molecular Formula | C8H11N3S |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 1.5004 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.06737 |
| Heavy Atoms | 12 |
| Complexity | 252.2653 |
Chemical Identifiers
| CAS Number | 112766-44-6 |
|---|---|
| SMILES | CSC(=NC1=CC=CC=C1)NN |
Product Overview
Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester (CAS 112766-44-6), with molecular formula C8H11N3S and molecular weight 181.07 g/mol. IUPAC: methyl N-amino-N'-phenylcarbamimidothioate.
Chemical Property Profile of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester
Property Insights of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester
The XLogP value of 1.5004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester. With a topological polar surface area (TPSA) of 50.41 Ų, Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester has 2 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 Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester?
The CAS number of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester is 112766-44-6.
What is the molecular formula of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester?
The molecular formula of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester is C8H11N3S.
What is the molecular weight of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester?
The molecular weight of Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester is 181.07 g/mol.
Where can I buy Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester?
You can request a quote for Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hydrazinecarboximidothioic acid, N-phenyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.