5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol
TL;DR: 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol (CAS 331849-80-0) is a chemical compound with molecular formula C20H21ClN2O2 and molecular weight 356.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-4-phenylbutan-1-one
Also Known As: BAS 00630768, 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol, 1-[5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-4-phenylbutan-1-one, 1-[5-(4-chlorophenyl)-5-hydroxy-3-methyl(2-pyrazolinyl)]-4-phenylbutan-1-one
| Molecular Formula | C20H21ClN2O2 |
|---|---|
| Molecular Weight | 356.13 g/mol |
| LogP | 4.1162 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.12915 |
| Heavy Atoms | 25 |
| Complexity | 774.04297 |
Chemical Identifiers
| CAS Number | 331849-80-0 |
|---|---|
| SMILES | CC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)CCCC3=CC=CC=C3 |
Product Overview
5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol (CAS 331849-80-0), with molecular formula C20H21ClN2O2 and molecular weight 356.13 g/mol. IUPAC: 1-[5-(4-chlorophenyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-4-phenylbutan-1-one.
Chemical Property Profile of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol
Property Insights of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol
The XLogP value of 4.1162 indicates that 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.9 Ų, 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol 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 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol?
The CAS number of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol is 331849-80-0.
What is the molecular formula of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol?
The molecular formula of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol is C20H21ClN2O2.
What is the molecular weight of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol?
The molecular weight of 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol is 356.13 g/mol.
Where can I buy 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol?
You can request a quote for 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-chlorophenyl)-3-methyl-1-(4-phenylbutanoyl)-4,5-dihydro-1H-pyrazol-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.