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N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide
TL;DR: N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide (CAS 478249-63-7) is a chemical compound with molecular formula C12H11FN2O and molecular weight 218.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide
Also Known As: N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide, N-(4-fluorobenzyl)-1H-pyrrole-2-carboxamide, 1H-Pyrrole-2-carboxamide, N-[(4-fluorophenyl)methyl]-, 1H-Pyrrole-2-carboxylic acid 4-fluoro-benzylamide
| Molecular Formula | C12H11FN2O |
|---|---|
| Molecular Weight | 218.09 g/mol |
| LogP | 2.0838 |
| Topological Polar Surface Area | 44.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.08554 |
| Heavy Atoms | 16 |
| Complexity | 462.2738 |
Chemical Identifiers
| CAS Number | 478249-63-7 |
|---|---|
| SMILES | C1=CNC(=C1)C(=O)NCC2=CC=C(C=C2)F |
Product Overview
N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide (CAS 478249-63-7), with molecular formula C12H11FN2O and molecular weight 218.09 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide.
Chemical Property Profile of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide
Property Insights of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide
The XLogP value of 2.0838 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide. With a topological polar surface area (TPSA) of 44.89 Ų, N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide has 2 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 N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide?
The CAS number of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide is 478249-63-7.
What is the molecular formula of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide?
The molecular formula of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide is C12H11FN2O.
What is the molecular weight of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide?
The molecular weight of N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide is 218.09 g/mol.
Where can I buy N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide?
You can request a quote for N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.