phenyl N-anilinobenzenecarboximidothioate
TL;DR: phenyl N-anilinobenzenecarboximidothioate (CAS 49829-70-1) is a chemical compound with molecular formula C19H16N2S and molecular weight 304.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N-anilinobenzenecarboximidothioate
Also Known As: phenyl N-anilinobenzenecarboximidothioate, Benzenecarbohydrazonothioic acid, N-phenyl-, phenyl ester
| Molecular Formula | C19H16N2S |
|---|---|
| Molecular Weight | 304.10 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.10342 |
| Heavy Atoms | 22 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 49829-70-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NNC2=CC=CC=C2)SC3=CC=CC=C3 |
| InChIKey | QREXDYHRAAISMP-UHFFFAOYSA-N |
Product Overview
phenyl N-anilinobenzenecarboximidothioate (CAS 49829-70-1), with molecular formula C19H16N2S and molecular weight 304.10 g/mol. IUPAC: phenyl N-anilinobenzenecarboximidothioate.
Chemical Property Profile of phenyl N-anilinobenzenecarboximidothioate
Property Insights of phenyl N-anilinobenzenecarboximidothioate
The XLogP value of 6.0 indicates that phenyl N-anilinobenzenecarboximidothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, phenyl N-anilinobenzenecarboximidothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, phenyl N-anilinobenzenecarboximidothioate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of phenyl N-anilinobenzenecarboximidothioate?
The CAS number of phenyl N-anilinobenzenecarboximidothioate is 49829-70-1.
What is the molecular formula of phenyl N-anilinobenzenecarboximidothioate?
The molecular formula of phenyl N-anilinobenzenecarboximidothioate is C19H16N2S.
What is the molecular weight of phenyl N-anilinobenzenecarboximidothioate?
The molecular weight of phenyl N-anilinobenzenecarboximidothioate is 304.10 g/mol.
Where can I buy phenyl N-anilinobenzenecarboximidothioate?
You can request a quote for phenyl N-anilinobenzenecarboximidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenyl N-anilinobenzenecarboximidothioate?
Yes, KEHONG BIO provides custom synthesis services for phenyl N-anilinobenzenecarboximidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.