![methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate structure](/static/products/857/85748-35-2.png)
methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate
TL;DR: methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate (CAS 85748-35-2) is a chemical compound with molecular formula C15H15N3S2 and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate
Also Known As: methyl N-[(E)-(2-phenyl-1-pyridin-2-ylethylidene)amino]carba, methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate
| Molecular Formula | C15H15N3S2 |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | 3.2659 |
| Topological Polar Surface Area | 37.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.07074 |
| Heavy Atoms | 20 |
| Complexity | 582.58234 |
Chemical Identifiers
| CAS Number | 85748-35-2 |
|---|---|
| SMILES | CSC(=S)NN=C(CC1=CC=CC=C1)C2=CC=CC=N2 |
Product Overview
methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate (CAS 85748-35-2), with molecular formula C15H15N3S2 and molecular weight 301.07 g/mol. IUPAC: methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate.
Chemical Property Profile of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate
Property Insights of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate
The XLogP value of 3.2659 indicates that methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.28 Ų, methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate has 1 hydrogen bond donor(s) and 4 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 methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate?
The CAS number of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate is 85748-35-2.
What is the molecular formula of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate?
The molecular formula of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate is C15H15N3S2.
What is the molecular weight of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate?
The molecular weight of methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate is 301.07 g/mol.
Where can I buy methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate?
You can request a quote for methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(2-phenyl-1-pyridin-2-ylethylidene)amino]carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.