2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate
TL;DR: 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate (CAS 1772-56-1) is a chemical compound with molecular formula C22H24O3 and molecular weight 336.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 5-oxo-2,3-diphenylcyclopentane-1-carboxylate
Also Known As: NCIOpen2_008901, 2-methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate, 2-methylpropyl 5-oxo-2,3-diphenylcyclopentane-1-carboxylate, Cyclopentanecarboxylicacid, 5-oxo-2,3-diphenyl-, 2-methylpropyl ester
| Molecular Formula | C22H24O3 |
|---|---|
| Molecular Weight | 336.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.17255 |
| Heavy Atoms | 25 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 1772-56-1 |
|---|---|
| SMILES | CC(C)COC(=O)C1C(C(CC1=O)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | HGGPSNUYMCSXLD-UHFFFAOYSA-N |
Product Overview
2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate (CAS 1772-56-1), with molecular formula C22H24O3 and molecular weight 336.17 g/mol. IUPAC: 2-methylpropyl 5-oxo-2,3-diphenylcyclopentane-1-carboxylate.
Chemical Property Profile of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate
Property Insights of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate
The XLogP value of 4.6 indicates that 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate has 0 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 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate?
The CAS number of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate is 1772-56-1.
What is the molecular formula of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate?
The molecular formula of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate is C22H24O3.
What is the molecular weight of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate?
The molecular weight of 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate is 336.17 g/mol.
Where can I buy 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate?
You can request a quote for 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylpropyl 5-oxo-2,3-diphenylcyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.