3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-
TL;DR: 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- (CAS 1084-23-7) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-phenyl-4,5,6,7-tetrahydroindazol-3-one
Also Known As: 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-, 1-Methyl-2-phenyl-4,5,6,7-tetrahydro-3-indazolinone, 4-24-00-00215 (Beilstein Handbook Reference), 1-methyl-2-phenyl-4,5,6,7-tetrahydroindazol-3-one, 1-Methyl-2-phenyl-1,2,4,5,6,7-hexahydro-3H-indazol-3-one
| Molecular Formula | C14H16N2O |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.12627 |
| Heavy Atoms | 17 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 1084-23-7 |
|---|---|
| SMILES | CN1C2=C(CCCC2)C(=O)N1C3=CC=CC=C3 |
| InChIKey | DRMOBFBTSAFUGB-UHFFFAOYSA-N |
Product Overview
3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- (CAS 1084-23-7), with molecular formula C14H16N2O and molecular weight 228.13 g/mol. IUPAC: 1-methyl-2-phenyl-4,5,6,7-tetrahydroindazol-3-one.
Chemical Property Profile of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-
Property Insights of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-. With a topological polar surface area (TPSA) of 23.6 Ų, 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- 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 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-?
The CAS number of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- is 1084-23-7.
What is the molecular formula of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-?
The molecular formula of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- is C14H16N2O.
What is the molecular weight of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-?
The molecular weight of 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- is 228.13 g/mol.
Where can I buy 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-?
You can request a quote for 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Indazolinone, 4,5,6,7-tetrahydro-1-methyl-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.