3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile
TL;DR: 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile (CAS 136831-49-7) is a chemical compound with molecular formula C14H8Cl2N2 and molecular weight 274.00644 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,5-dichlorophenyl)-2-pyridin-3-ylprop-2-enenitrile
Also Known As: Tyrphostin RG 14620, Tyrphostin RG14620, KBio2_000494, KBio2_003062, KBio2_005630
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H8Cl2N2 |
| Molecular Weight | 274.00644 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 36.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.00644 Da |
| Heavy Atoms | 18 |
| Complexity | 348.0 |
| SMILES | C1=CC(=CN=C1)C(=CC2=CC(=CC(=C2)Cl)Cl)C#N |
| InChIKey | TYXIVBJQPBWBHO-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile
Property Insights of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile
The XLogP value of 3.9 indicates that 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.7 Ų, 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile 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
What is the CAS number of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile?
The CAS number of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile is 136831-49-7.
What is the molecular formula of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile?
The molecular formula of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile is C14H8Cl2N2.
What is the molecular weight of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile?
The molecular weight of 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile is 274.00644 g/mol.
Where can I buy 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile?
You can request a quote for 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile?
Yes, CoreyChem provides custom synthesis services for 3-(3,5-Dichlorophenyl)-2-(3-pyridinyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.