1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-
TL;DR: 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- (CAS 116834-28-7) is a chemical compound with molecular formula C16H14ClN3O2 and molecular weight 315.07745 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(4-chlorophenyl)-5-pyrrol-1-ylpyrazol-4-yl]propanoic acid
Also Known As: 1-(4-Chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-acetic acid, 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-, 2-[1-(4-chlorophenyl)-5-pyrrol-1-ylpyrazol-4-yl]propanoic acid, 2-[1-(4-Chlorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]propanoic acid
Technical Specifications
| Molecular Formula | C16H14ClN3O2 |
| Molecular Weight | 315.07745 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 60.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.07745 Da |
| Heavy Atoms | 22 |
| Complexity | 395.0 |
| SMILES | CC(C1=C(N(N=C1)C2=CC=C(C=C2)Cl)N3C=CC=C3)C(=O)O |
| InChIKey | QHIIOMGBOWWBRG-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-
Property Insights of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-
The XLogP value of 3.3 indicates that 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-. Following Lipinski's Rule of Five, 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- 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
What is the CAS number of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-?
The CAS number of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- is 116834-28-7.
What is the molecular formula of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-?
The molecular formula of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- is C16H14ClN3O2.
What is the molecular weight of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-?
The molecular weight of 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- is 315.07745 g/mol.
Where can I buy 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-?
You can request a quote for 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)-?
Yes, CoreyChem provides custom synthesis services for 1H-Pyrazole-4-acetic acid, 1-(4-chlorophenyl)-alpha-methyl-5-(1H-pyrrol-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.