3-Pyridinecarbonitrile, 1,4-dihydro-
TL;DR: 3-Pyridinecarbonitrile, 1,4-dihydro- (CAS 23974-91-6) is a chemical compound with molecular formula C6H6N2 and molecular weight 106.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydropyridine-3-carbonitrile
Also Known As: 1,4-dihydropyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 1,4-dihydro-, 3-cyano-1,4-dihydropyridine, 1,4-Dihydro-3-pyridinecarbonitrile, 3-Pyridinecarbonitrile,1,4-dihydro
| Molecular Formula | C6H6N2 |
|---|---|
| Molecular Weight | 106.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 106.0531 |
| Heavy Atoms | 8 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 23974-91-6 |
|---|---|
| SMILES | C1C=CNC=C1C#N |
| InChIKey | OHOODZGNNBPUPK-UHFFFAOYSA-N |
Product Overview
3-Pyridinecarbonitrile, 1,4-dihydro- (CAS 23974-91-6), with molecular formula C6H6N2 and molecular weight 106.05 g/mol. IUPAC: 1,4-dihydropyridine-3-carbonitrile.
Chemical Property Profile of 3-Pyridinecarbonitrile, 1,4-dihydro-
Property Insights of 3-Pyridinecarbonitrile, 1,4-dihydro-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarbonitrile, 1,4-dihydro-. With a topological polar surface area (TPSA) of 35.8 Ų, 3-Pyridinecarbonitrile, 1,4-dihydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinecarbonitrile, 1,4-dihydro- has 1 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 3-Pyridinecarbonitrile, 1,4-dihydro-?
The CAS number of 3-Pyridinecarbonitrile, 1,4-dihydro- is 23974-91-6.
What is the molecular formula of 3-Pyridinecarbonitrile, 1,4-dihydro-?
The molecular formula of 3-Pyridinecarbonitrile, 1,4-dihydro- is C6H6N2.
What is the molecular weight of 3-Pyridinecarbonitrile, 1,4-dihydro-?
The molecular weight of 3-Pyridinecarbonitrile, 1,4-dihydro- is 106.05 g/mol.
Where can I buy 3-Pyridinecarbonitrile, 1,4-dihydro-?
You can request a quote for 3-Pyridinecarbonitrile, 1,4-dihydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarbonitrile, 1,4-dihydro-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarbonitrile, 1,4-dihydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.