![7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one structure](/static/products/575/57595-82-1.png)
7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one
TL;DR: 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one (CAS 57595-82-1) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one
Also Known As: 7-methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one, 3H-Benz[g]indazol-3-one, 2,3a,4,5-tetrahydro-7-methoxy-, 7-Methoxy-2,3a,4,5-tetrahydro-3H-benzo[g]indazol-3-one, (S)-2,4,5-TETRAHYDRO-7-METHOXY-3H-BENZ[G]INDAZOL-3-ONE, 11-methoxy-3,4-diazatricyclo[7.4.0.0^{2,6}]trideca-1(9),2,10,12-tetraen-5-one
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 57595-82-1 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=NNC(=O)C3CC2 |
| InChIKey | JQUHKKOKUQOLDW-UHFFFAOYSA-N |
Product Overview
7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one (CAS 57595-82-1), with molecular formula C12H12N2O2 and molecular weight 216.09 g/mol. IUPAC: 7-methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one.
Chemical Property Profile of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one
Property Insights of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one. With a topological polar surface area (TPSA) of 50.7 Ų, 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one has 1 hydrogen bond donor(s) and 3 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 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one?
The CAS number of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one is 57595-82-1.
What is the molecular formula of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one?
The molecular formula of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one is C12H12N2O2.
What is the molecular weight of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one?
The molecular weight of 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one is 216.09 g/mol.
Where can I buy 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one?
You can request a quote for 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Methoxy-2,3a,4,5-tetrahydrobenzo[g]indazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.