![4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile structure](/static/products/3873/387352-97-8.webp)
4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile
TL;DR: 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile (CAS 387352-97-8) is a chemical compound with molecular formula C15H15Cl2N3 and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(2,6-dichlorophenyl)methyl]-3,5-dimethylpyrazol-1-yl]propanenitrile
Also Known As: Maybridge3_001061, IDI1_012448, BRD-K61450278-001-01-1, 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile, 3-[4-[(2,6-dichlorophenyl)methyl]-3,5-dimethylpyrazol-1-yl]propanenitrile
| Molecular Formula | C15H15Cl2N3 |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 4.31122 |
| Topological Polar Surface Area | 41.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.0643 |
| Heavy Atoms | 20 |
| Complexity | 648.23865 |
Chemical Identifiers
| CAS Number | 387352-97-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CCC#N)C)CC2=C(C=CC=C2Cl)Cl |
Product Overview
4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile (CAS 387352-97-8), with molecular formula C15H15Cl2N3 and molecular weight 307.06 g/mol. IUPAC: 3-[4-[(2,6-dichlorophenyl)methyl]-3,5-dimethylpyrazol-1-yl]propanenitrile.
Chemical Property Profile of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile
Property Insights of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile
The XLogP value of 4.31122 indicates that 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.61 Ų, 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile 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 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile?
The CAS number of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile is 387352-97-8.
What is the molecular formula of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile?
The molecular formula of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile is C15H15Cl2N3.
What is the molecular weight of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile?
The molecular weight of 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile is 307.06 g/mol.
Where can I buy 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile?
You can request a quote for 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,6-Dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazole-1-propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.