![{[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile structure](/static/products/845/845983-96-2.png)
{[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile
TL;DR: {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile (CAS 845983-96-2) is a chemical compound with molecular formula C15H10ClN3 and molecular weight 267.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-chlorophenyl)-1-methylpyrrol-2-yl]methylidene]propanedinitrile
Also Known As: {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile, 2-((5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl)methylene)malononitrile, 2-[[5-(3-chlorophenyl)-1-methylpyrrol-2-yl]methylidene]propanedinitrile
| Molecular Formula | C15H10ClN3 |
|---|---|
| Molecular Weight | 267.06 g/mol |
| LogP | 3.77606 |
| Topological Polar Surface Area | 52.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.05634 |
| Heavy Atoms | 19 |
| Complexity | 710.57947 |
Chemical Identifiers
| CAS Number | 845983-96-2 |
|---|---|
| SMILES | CN1C(=CC=C1C2=CC(=CC=C2)Cl)C=C(C#N)C#N |
Product Overview
{[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile (CAS 845983-96-2), with molecular formula C15H10ClN3 and molecular weight 267.06 g/mol. IUPAC: 2-[[5-(3-chlorophenyl)-1-methylpyrrol-2-yl]methylidene]propanedinitrile.
Chemical Property Profile of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile
Property Insights of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile
The XLogP value of 3.77606 indicates that {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.51 Ų, {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile has 0 hydrogen bond donor(s) and 2 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 {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile?
The CAS number of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile is 845983-96-2.
What is the molecular formula of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile?
The molecular formula of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile is C15H10ClN3.
What is the molecular weight of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile?
The molecular weight of {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile is 267.06 g/mol.
Where can I buy {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile?
You can request a quote for {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for {[5-(3-chlorophenyl)-1-methyl-1H-pyrrol-2-yl]methylidene}propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.