2W-0240
TL;DR: 2W-0240 (CAS 861210-01-7) is a chemical compound with molecular formula C18H13F3N4O and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)ethenyl]-3-(trifluoromethyl)benzamide
Also Known As: 2W-0240, N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)ethenyl]-3-(trifluoromethyl)benzamide, N-[(1E)-1,2-dicyano-2-(2,5-dimethyl-1H-pyrrol-1-yl)eth-1-en-1-yl]-3-(trifluoromethyl)benzamide, N-[(E)-1,2-dicyano-2-(2,5-dimethyl-1H-pyrrol-1-yl)ethenyl]-3-(trifluoromethyl)benzenecarboxamide
| Molecular Formula | C18H13F3N4O |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 3.7695 |
| Topological Polar Surface Area | 81.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.10416 |
| Heavy Atoms | 26 |
| Complexity | 952.04315 |
Chemical Identifiers
| CAS Number | 861210-01-7 |
|---|---|
| SMILES | CC1=CC=C(N1/C(=C(\C#N)/NC(=O)C2=CC(=CC=C2)C(F)(F)F)/C#N)C |
Product Overview
2W-0240 (CAS 861210-01-7), with molecular formula C18H13F3N4O and molecular weight 358.10 g/mol. IUPAC: N-[(E)-1,2-dicyano-2-(2,5-dimethylpyrrol-1-yl)ethenyl]-3-(trifluoromethyl)benzamide.
Chemical Property Profile of 2W-0240
Property Insights of 2W-0240
The XLogP value of 3.7695 indicates that 2W-0240 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2W-0240. Following Lipinski's Rule of Five, 2W-0240 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 2W-0240?
The CAS number of 2W-0240 is 861210-01-7.
What is the molecular formula of 2W-0240?
The molecular formula of 2W-0240 is C18H13F3N4O.
What is the molecular weight of 2W-0240?
The molecular weight of 2W-0240 is 358.10 g/mol.
Where can I buy 2W-0240?
You can request a quote for 2W-0240 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2W-0240?
Yes, KEHONG BIO provides custom synthesis services for 2W-0240 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.