3-Anilino-1-phenyl-1H-pyrrole-2,5-dione
TL;DR: 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione (CAS 138355-97-2) is a chemical compound with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-anilino-1-phenylpyrrole-2,5-dione
Also Known As: Maybridge1_007326, 3-anilino-1-phenyl-1h-pyrrole-2,5-dione, 3-anilino-1-phenylpyrrole-2,5-dione, 3-anilino-N-phenylmaleimide, 1-phenyl-3-(phenylamino)-1H-pyrrole-2,5-dione
| Molecular Formula | C16H12N2O2 |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.08987 |
| Heavy Atoms | 20 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 138355-97-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC(=O)N(C2=O)C3=CC=CC=C3 |
| InChIKey | KTGOYNWJJKTCKT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Anilino-1-phenyl-1H-pyrrole-2,5-dione (CAS 138355-97-2), with molecular formula C16H12N2O2 and molecular weight 264.09 g/mol. IUPAC: 3-anilino-1-phenylpyrrole-2,5-dione.
Chemical Property Profile of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione
Property Insights of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione 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-Anilino-1-phenyl-1H-pyrrole-2,5-dione?
The CAS number of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione is 138355-97-2.
What is the molecular formula of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione?
The molecular formula of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione is C16H12N2O2.
What is the molecular weight of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione?
The molecular weight of 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione is 264.09 g/mol.
Where can I buy 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione?
You can request a quote for 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Anilino-1-phenyl-1H-pyrrole-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.