F0729-0102
TL;DR: F0729-0102 (CAS 326022-90-6) is a chemical compound with molecular formula C22H16N4O and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(E)-1-(1-methylpyrrol-2-yl)-3-oxo-3-phenylprop-1-en-2-yl]-2-pyridinylidene]propanedinitrile
Also Known As: F0729-0102, (E)-2-(1-(1-(1-methyl-1H-pyrrol-2-yl)-3-oxo-3-phenylprop-1-en-2-yl)pyridin-2(1H)-ylidene)malononitrile, 2-[1-[(E)-1-(1-methylpyrrol-2-yl)-3-oxo-3-phenylprop-1-en-2-yl]pyridin-2-ylidene]propanedinitrile, 2-{1-[(1E)-1-(1-methyl-1H-pyrrol-2-yl)-3-oxo-3-phenylprop-1-en-2-yl]-1,2-dihydropyridin-2-ylidene}propanedinitrile, {1-[(E)-1-benzoyl-2-(1-methyl-2-pyrrolyl)ethenyl]-1,2-dihydro-2-pyridylidene}propanedinitrile
| Molecular Formula | C22H16N4O |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 3.93566 |
| Topological Polar Surface Area | 72.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.13242 |
| Heavy Atoms | 27 |
| Complexity | 1053.5063 |
Chemical Identifiers
| CAS Number | 326022-90-6 |
|---|---|
| SMILES | CN1C=CC=C1/C=C(\C(=O)C2=CC=CC=C2)/N3C=CC=CC3=C(C#N)C#N |
Product Overview
F0729-0102 (CAS 326022-90-6), with molecular formula C22H16N4O and molecular weight 352.13 g/mol. IUPAC: 2-[1-[(E)-1-(1-methylpyrrol-2-yl)-3-oxo-3-phenylprop-1-en-2-yl]-2-pyridinylidene]propanedinitrile.
Chemical Property Profile of F0729-0102
Property Insights of F0729-0102
The XLogP value of 3.93566 indicates that F0729-0102 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.82 Ų falls within the moderate polarity range, balancing permeability and solubility for F0729-0102. Following Lipinski's Rule of Five, F0729-0102 has 0 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 F0729-0102?
The CAS number of F0729-0102 is 326022-90-6.
What is the molecular formula of F0729-0102?
The molecular formula of F0729-0102 is C22H16N4O.
What is the molecular weight of F0729-0102?
The molecular weight of F0729-0102 is 352.13 g/mol.
Where can I buy F0729-0102?
You can request a quote for F0729-0102 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0729-0102?
Yes, KEHONG BIO provides custom synthesis services for F0729-0102 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.