Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-
TL;DR: Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- (CAS 372973-89-2) is a chemical compound with molecular formula C11H11N3OS and molecular weight 233.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-cyano-3-(2-methoxyanilino)prop-2-enethioamide
Also Known As: (Z)-2-cyano-3-(2-methoxyanilino)prop-2-enethioamide, (2Z)-2-Cyano-3-(2-methoxyanilino)-2-propenethioamide #, (Z)-2-cyano-3-((2-methoxyphenyl)amino)prop-2-enethioamide, Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-
| Molecular Formula | C11H11N3OS |
|---|---|
| Molecular Weight | 233.06 g/mol |
| LogP | 1.80068 |
| Topological Polar Surface Area | 71.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.06229 |
| Heavy Atoms | 16 |
| Complexity | 462.54263 |
Chemical Identifiers
| CAS Number | 372973-89-2 |
|---|---|
| SMILES | COC1=CC=CC=C1N/C=C(/C#N)\C(=S)N |
Product Overview
Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- (CAS 372973-89-2), with molecular formula C11H11N3OS and molecular weight 233.06 g/mol. IUPAC: (Z)-2-cyano-3-(2-methoxyanilino)prop-2-enethioamide.
Chemical Property Profile of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-
Property Insights of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-
The XLogP value of 1.80068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-. The TPSA of 71.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-. Following Lipinski's Rule of Five, Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- has 2 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 Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-?
The CAS number of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- is 372973-89-2.
What is the molecular formula of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-?
The molecular formula of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- is C11H11N3OS.
What is the molecular weight of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-?
The molecular weight of Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- is 233.06 g/mol.
Where can I buy Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-?
You can request a quote for Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl-?
Yes, KEHONG BIO provides custom synthesis services for Propenenitrile, 3-(2-methoxyphenylamino)-2-thiocarbamoyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.