3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-
TL;DR: 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- (CAS 55651-30-4) is a chemical compound with molecular formula C14H14N2O2 and molecular weight 242.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)acetic acid
Also Known As: Poli 44, KST-1A6009, (1-phenyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)acetic acid, 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-, 1,4,5,6-Tetrahydro-1-phenyl-3-cyclopentapyrazoleacetic acid
| Molecular Formula | C14H14N2O2 |
|---|---|
| Molecular Weight | 242.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.10553 |
| Heavy Atoms | 18 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 55651-30-4 |
|---|---|
| SMILES | C1CC2=C(C1)N(N=C2CC(=O)O)C3=CC=CC=C3 |
| InChIKey | WTMWGZQAMBPICC-UHFFFAOYSA-N |
Product Overview
3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- (CAS 55651-30-4), with molecular formula C14H14N2O2 and molecular weight 242.11 g/mol. IUPAC: 2-(1-phenyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-yl)acetic acid.
Chemical Property Profile of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-
Property Insights of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-. With a topological polar surface area (TPSA) of 55.1 Ų, 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- 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 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-?
The CAS number of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- is 55651-30-4.
What is the molecular formula of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-?
The molecular formula of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- is C14H14N2O2.
What is the molecular weight of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-?
The molecular weight of 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- is 242.11 g/mol.
Where can I buy 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-?
You can request a quote for 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclopentapyrazoleacetic acid, 1,4,5,6-tetrahydro-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.