1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-
TL;DR: 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- (CAS 65473-92-9) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-5-phenylpyrrole-3-carboxylic acid
Also Known As: 1,2-Dimethyl-5-phenyl-1H-pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenylpyrrole-3-carboxylic acid, 1,2-Dimethyl-5-phenyl-imidazolin-4-on, 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-, AR-415/42582679
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.69872 |
| Topological Polar Surface Area | 42.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 526.36566 |
Chemical Identifiers
| CAS Number | 65473-92-9 |
|---|---|
| SMILES | CC1=C(C=C(N1C)C2=CC=CC=C2)C(=O)O |
Product Overview
1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- (CAS 65473-92-9), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 1,2-dimethyl-5-phenylpyrrole-3-carboxylic acid.
Chemical Property Profile of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-
Property Insights of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-
The XLogP value of 2.69872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-. With a topological polar surface area (TPSA) of 42.23 Ų, 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- has 1 hydrogen bond donor(s) and 1 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 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-?
The CAS number of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- is 65473-92-9.
What is the molecular formula of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-?
The molecular formula of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- is C13H13NO2.
What is the molecular weight of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-?
The molecular weight of 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- is 215.09 g/mol.
Where can I buy 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-?
You can request a quote for 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrrole-3-carboxylic acid, 1,2-dimethyl-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.