p-Aminobenzothiamide
TL;DR: p-Aminobenzothiamide (CAS 4114-67-4) is a chemical compound with molecular formula C7H8N2S and molecular weight 152.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-aminobenzenecarbothioamide
Also Known As: 4-Aminothiobenzamide, 4-AMINOBENZOTHIOAMIDE, 4-Aminobenzenecarbothioamide, p-Aminobenzothiamide, p-Aminothiobenzamide
| Molecular Formula | C7H8N2S |
|---|---|
| Molecular Weight | 152.04 g/mol |
| LogP | 0.903 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.04082 |
| Heavy Atoms | 10 |
| Complexity | 240.28795 |
Chemical Identifiers
| CAS Number | 4114-67-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=S)N)N |
Product Overview
p-Aminobenzothiamide (CAS 4114-67-4), with molecular formula C7H8N2S and molecular weight 152.04 g/mol. IUPAC: 4-aminobenzenecarbothioamide.
Chemical Property Profile of p-Aminobenzothiamide
Property Insights of p-Aminobenzothiamide
The XLogP value of 0.903 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Aminobenzothiamide. With a topological polar surface area (TPSA) of 52.04 Ų, p-Aminobenzothiamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Aminobenzothiamide 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 p-Aminobenzothiamide?
The CAS number of p-Aminobenzothiamide is 4114-67-4.
What is the molecular formula of p-Aminobenzothiamide?
The molecular formula of p-Aminobenzothiamide is C7H8N2S.
What is the molecular weight of p-Aminobenzothiamide?
The molecular weight of p-Aminobenzothiamide is 152.04 g/mol.
Where can I buy p-Aminobenzothiamide?
You can request a quote for p-Aminobenzothiamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Aminobenzothiamide?
Yes, KEHONG BIO provides custom synthesis services for p-Aminobenzothiamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.