4-Methylsulfanyl-benzamidine
TL;DR: 4-Methylsulfanyl-benzamidine (CAS 412307-75-6) is a chemical compound with molecular formula C8H10N2S and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanylbenzenecarboximidamide
Also Known As: 4-(Methylthio)benzimidamide, 4-METHYLSULFANYL-BENZAMIDINE, 4-methylsulfanylbenzamidine, 4-(methylthio)benzamidine, 4-methylsulfanylbenzenecarboximidamide
| Molecular Formula | C8H10N2S |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.69257 |
| Topological Polar Surface Area | 49.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.05647 |
| Heavy Atoms | 11 |
| Complexity | 253.2995 |
Chemical Identifiers
| CAS Number | 412307-75-6 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)C(=N)N |
Product Overview
4-Methylsulfanyl-benzamidine (CAS 412307-75-6), with molecular formula C8H10N2S and molecular weight 166.06 g/mol. IUPAC: 4-methylsulfanylbenzenecarboximidamide.
Chemical Property Profile of 4-Methylsulfanyl-benzamidine
Property Insights of 4-Methylsulfanyl-benzamidine
The XLogP value of 1.69257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylsulfanyl-benzamidine. With a topological polar surface area (TPSA) of 49.87 Ų, 4-Methylsulfanyl-benzamidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylsulfanyl-benzamidine 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 4-Methylsulfanyl-benzamidine?
The CAS number of 4-Methylsulfanyl-benzamidine is 412307-75-6.
What is the molecular formula of 4-Methylsulfanyl-benzamidine?
The molecular formula of 4-Methylsulfanyl-benzamidine is C8H10N2S.
What is the molecular weight of 4-Methylsulfanyl-benzamidine?
The molecular weight of 4-Methylsulfanyl-benzamidine is 166.06 g/mol.
Where can I buy 4-Methylsulfanyl-benzamidine?
You can request a quote for 4-Methylsulfanyl-benzamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylsulfanyl-benzamidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylsulfanyl-benzamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.