3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole
TL;DR: 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole (CAS 70332-88-6) is a chemical compound with molecular formula C11H10N2 and molecular weight 170.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diazatetracyclo[7.4.0.02,6.03,8]trideca-1(13),4,9,11-tetraene
Also Known As: RCL T209163, 2,3-diaza-7,8-benzotricyclonona-2,7-diene, 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole, 8,9-diaza-4,5-benzotricyclo<4.3.0.03,7>octa-4,8-dien, 2,3-diaza-7,8-benzotricyclo<4.3.0.04,9>nona-2,7-diene
| Molecular Formula | C11H10N2 |
|---|---|
| Molecular Weight | 170.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.0844 |
| Heavy Atoms | 13 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 70332-88-6 |
|---|---|
| SMILES | C1C2C3C(C1N=N3)C4=CC=CC=C24 |
| InChIKey | JKPDPNOIHBPTCM-UHFFFAOYSA-N |
Product Overview
3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole (CAS 70332-88-6), with molecular formula C11H10N2 and molecular weight 170.08 g/mol. IUPAC: 4,5-diazatetracyclo[7.4.0.02,6.03,8]trideca-1(13),4,9,11-tetraene.
Chemical Property Profile of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole
Property Insights of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole. With a topological polar surface area (TPSA) of 24.7 Ų, 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole 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 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole?
The CAS number of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole is 70332-88-6.
What is the molecular formula of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole?
The molecular formula of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole is C11H10N2.
What is the molecular weight of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole?
The molecular weight of 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole is 170.08 g/mol.
Where can I buy 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole?
You can request a quote for 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3,3a,8,8a-Tetrahydro-3,8-methanoindeno[2,1-c]pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.