Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-
TL;DR: Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- (CAS 101091-99-0) is a chemical compound with molecular formula C15H15N3S and molecular weight 269.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z)-1-[amino(phenyl)methylidene]-3-(4-methylphenyl)thiourea
Also Known As: Benzaldehyde, 4-p-tolyl-3-thiosemicarbazone, 4-12-00-01932 (Beilstein Handbook Reference), Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-, J3.681.542F, N-(((4-Methylphenyl)amino)thioxomethyl)benzenecarboximidamide
| Molecular Formula | C15H15N3S |
|---|---|
| Molecular Weight | 269.10 g/mol |
| LogP | 3.09732 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.09866 |
| Heavy Atoms | 19 |
| Complexity | 588.54755 |
Chemical Identifiers
| CAS Number | 101091-99-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)/N=C(/C2=CC=CC=C2)\N |
Product Overview
Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- (CAS 101091-99-0), with molecular formula C15H15N3S and molecular weight 269.10 g/mol. IUPAC: (1Z)-1-[amino(phenyl)methylidene]-3-(4-methylphenyl)thiourea.
Chemical Property Profile of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-
Property Insights of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-
The XLogP value of 3.09732 indicates that Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.41 Ų, Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- has 2 hydrogen bond donor(s) and 1 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 Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-?
The CAS number of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- is 101091-99-0.
What is the molecular formula of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-?
The molecular formula of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- is C15H15N3S.
What is the molecular weight of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-?
The molecular weight of Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- is 269.10 g/mol.
Where can I buy Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-?
You can request a quote for Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenecarboximidamide, N-(((4-methylphenyl)amino)thioxomethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.