5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one
TL;DR: 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one (CAS 18209-08-0) is a chemical compound with molecular formula C23H24N2O and molecular weight 344.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one
Also Known As: 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one, 5,6a-Diethyl-3-methyl-3a,4-diphenyl-3a,6a-dihydrocyclopenta[c]pyrazol-6(3H)-one
| Molecular Formula | C23H24N2O |
|---|---|
| Molecular Weight | 344.19 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.18887 |
| Heavy Atoms | 26 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 18209-08-0 |
|---|---|
| SMILES | CCC1=C(C2(C(N=NC2(C1=O)CC)C)C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | PFPNGSCXAXYULL-UHFFFAOYSA-N |
Product Overview
5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one (CAS 18209-08-0), with molecular formula C23H24N2O and molecular weight 344.19 g/mol. IUPAC: 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one.
Chemical Property Profile of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one
Property Insights of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one
The XLogP value of 5.2 indicates that 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.8 Ų, 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one?
The CAS number of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one is 18209-08-0.
What is the molecular formula of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one?
The molecular formula of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one is C23H24N2O.
What is the molecular weight of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one?
The molecular weight of 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one is 344.19 g/mol.
Where can I buy 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one?
You can request a quote for 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6a-diethyl-3-methyl-3a,4-diphenyl-3H-cyclopenta[c]pyrazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.