3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile
TL;DR: 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile (CAS 251310-75-5) is a chemical compound with molecular formula C17H15N3O2 and molecular weight 293.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile
Also Known As: 3-(4-benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile, 3-(4-benzoyl-1-methyl-1H-pyrrol-2-yl)-2-[(methoxyimino)methyl]prop-2-enenitrile, 3-(4-benzoyl-1-methyl-pyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile, 3-(4-benzoyl-1-methyl-1H-pyrrol-2-yl)-2-[(methoxyimino)methyl]acrylonitrile
| Molecular Formula | C17H15N3O2 |
|---|---|
| Molecular Weight | 293.12 g/mol |
| LogP | 2.79528 |
| Topological Polar Surface Area | 67.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.11642 |
| Heavy Atoms | 22 |
| Complexity | 764.9469 |
Chemical Identifiers
| CAS Number | 251310-75-5 |
|---|---|
| SMILES | CN1C=C(C=C1C=C(C=NOC)C#N)C(=O)C2=CC=CC=C2 |
Product Overview
3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile (CAS 251310-75-5), with molecular formula C17H15N3O2 and molecular weight 293.12 g/mol. IUPAC: 3-(4-benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile.
Chemical Property Profile of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile
Property Insights of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile
The XLogP value of 2.79528 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile. The TPSA of 67.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile. Following Lipinski's Rule of Five, 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile 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 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile?
The CAS number of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile is 251310-75-5.
What is the molecular formula of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile?
The molecular formula of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile is C17H15N3O2.
What is the molecular weight of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile?
The molecular weight of 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile is 293.12 g/mol.
Where can I buy 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile?
You can request a quote for 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Benzoyl-1-methylpyrrol-2-yl)-2-(methoxyiminomethyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.