4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole
TL;DR: 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole (CAS 52837-55-5) is a chemical compound with molecular formula C16H13N3 and molecular weight 247.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-4-yl-4,5-dihydro-1H-benzo[g]indazole
Also Known As: 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole, 3-pyridin-4-yl-4,5-dihydro-1H-benzo[g]indazole, NCI60_001979, 3-(4-Pyridyl)-4,5-dihydro-1H-benzo[g]indazole, 3-(Pyridin-4-yl)-4,5-dihydro-1H-benzo[g]indazole
| Molecular Formula | C16H13N3 |
|---|---|
| Molecular Weight | 247.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.11095 |
| Heavy Atoms | 19 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 52837-55-5 |
|---|---|
| SMILES | C1CC2=C(C3=CC=CC=C31)NN=C2C4=CC=NC=C4 |
| InChIKey | NNOXRNQSZZKVKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole (CAS 52837-55-5), with molecular formula C16H13N3 and molecular weight 247.11 g/mol. IUPAC: 3-pyridin-4-yl-4,5-dihydro-1H-benzo[g]indazole.
Chemical Property Profile of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole
Property Insights of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole. With a topological polar surface area (TPSA) of 41.6 Ų, 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole 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 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole?
The CAS number of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole is 52837-55-5.
What is the molecular formula of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole?
The molecular formula of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole is C16H13N3.
What is the molecular weight of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole?
The molecular weight of 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole is 247.11 g/mol.
Where can I buy 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole?
You can request a quote for 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dihydro-3-(pyridin-4-yl)-2H-benz(g)indazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.