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N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide
TL;DR: N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide (CAS 477885-83-9) is a chemical compound with molecular formula C17H14N2OS and molecular weight 294.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-cyanophenyl)sulfanyl-N-prop-2-enylbenzamide
Also Known As: Bionet2_000860, 2-[(2-cyanophenyl)sulfanyl]-N-(prop-2-en-1-yl)benzamide, 2L-359S, N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide, N-Allyl-2-((2-cyanophenyl)sulfanyl)benzenecarboxamide
| Molecular Formula | C17H14N2OS |
|---|---|
| Molecular Weight | 294.08 g/mol |
| LogP | 3.62528 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.08267 |
| Heavy Atoms | 21 |
| Complexity | 703.93146 |
Chemical Identifiers
| CAS Number | 477885-83-9 |
|---|---|
| SMILES | C=CCNC(=O)C1=CC=CC=C1SC2=CC=CC=C2C#N |
Product Overview
N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide (CAS 477885-83-9), with molecular formula C17H14N2OS and molecular weight 294.08 g/mol. IUPAC: 2-(2-cyanophenyl)sulfanyl-N-prop-2-enylbenzamide.
Chemical Property Profile of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide
Property Insights of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide
The XLogP value of 3.62528 indicates that N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide has 1 hydrogen bond donor(s) and 3 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 N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide?
The CAS number of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide is 477885-83-9.
What is the molecular formula of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide?
The molecular formula of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide is C17H14N2OS.
What is the molecular weight of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide?
The molecular weight of N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide is 294.08 g/mol.
Where can I buy N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide?
You can request a quote for N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-2-[(2-cyanophenyl)sulfanyl]benzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.