N-Methyl-1-phenylhydrazine-1-carbothioamide
TL;DR: N-Methyl-1-phenylhydrazine-1-carbothioamide (CAS 21076-10-8) 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.
1-amino-3-methyl-1-phenylthiourea
Also Known As: 1-amino-3-methyl-1-phenylthiourea, 4-methyl-2-phenyl thiosemicarbazide, 1-amino-3-methyl-1-phenyl-thiourea, N-Methyl-1-phenylhydrazine-1-carbothioamide, N-methyl-1-phenylhydrazinecarbothioamide
| Molecular Formula | C8H11N3S |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 0.871 |
| Topological Polar Surface Area | 41.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.06737 |
| Heavy Atoms | 12 |
| Complexity | 260.2653 |
Chemical Identifiers
| CAS Number | 21076-10-8 |
|---|---|
| SMILES | CNC(=S)N(C1=CC=CC=C1)N |
Product Overview
N-Methyl-1-phenylhydrazine-1-carbothioamide (CAS 21076-10-8), with molecular formula C8H11N3S and molecular weight 181.07 g/mol. IUPAC: 1-amino-3-methyl-1-phenylthiourea.
Chemical Property Profile of N-Methyl-1-phenylhydrazine-1-carbothioamide
Property Insights of N-Methyl-1-phenylhydrazine-1-carbothioamide
The XLogP value of 0.871 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-1-phenylhydrazine-1-carbothioamide. With a topological polar surface area (TPSA) of 41.29 Ų, N-Methyl-1-phenylhydrazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl-1-phenylhydrazine-1-carbothioamide has 2 hydrogen bond donor(s) and 2 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 N-Methyl-1-phenylhydrazine-1-carbothioamide?
The CAS number of N-Methyl-1-phenylhydrazine-1-carbothioamide is 21076-10-8.
What is the molecular formula of N-Methyl-1-phenylhydrazine-1-carbothioamide?
The molecular formula of N-Methyl-1-phenylhydrazine-1-carbothioamide is C8H11N3S.
What is the molecular weight of N-Methyl-1-phenylhydrazine-1-carbothioamide?
The molecular weight of N-Methyl-1-phenylhydrazine-1-carbothioamide is 181.07 g/mol.
Where can I buy N-Methyl-1-phenylhydrazine-1-carbothioamide?
You can request a quote for N-Methyl-1-phenylhydrazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-1-phenylhydrazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-1-phenylhydrazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.