3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)
TL;DR: 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) (CAS 6122-46-9) is a chemical compound with molecular formula C18H19N5O8 and molecular weight 433.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)-1-phenylpyrrolidin-2-one;2,4,6-trinitrophenol
Also Known As: 3-Dimethylamino-1-phenyl-2-pyrrolidinone picrate, 2-Pyrrolidinone, 3-dimethylamino-1-phenyl-, picrate, 3-(dimethylamino)-1-phenylpyrrolidin-2-one- 2,4,6-trinitrophenol(1:1), 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1), 3-(dimethylamino)-1-phenylpyrrolidin-2-one; 2,4,6-trinitrophenol
| Molecular Formula | C18H19N5O8 |
|---|---|
| Molecular Weight | 433.12 g/mol |
| LogP | 2.47 |
| Topological Polar Surface Area | 181.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 433.12335 |
| Heavy Atoms | 31 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 6122-46-9 |
|---|---|
| SMILES | CN(C)C1CCN(C1=O)C2=CC=CC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KRAQAOBRFYZSEU-UHFFFAOYSA-N |
Product Overview
3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) (CAS 6122-46-9), with molecular formula C18H19N5O8 and molecular weight 433.12 g/mol. IUPAC: 3-(dimethylamino)-1-phenylpyrrolidin-2-one;2,4,6-trinitrophenol.
Chemical Property Profile of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)
Property Insights of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)
The XLogP value of 2.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1). The TPSA of 181.0 Ų indicates high polarity, suggesting 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) has 1 hydrogen bond donor(s) and 9 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-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)?
The CAS number of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) is 6122-46-9.
What is the molecular formula of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)?
The molecular formula of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) is C18H19N5O8.
What is the molecular weight of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)?
The molecular weight of 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) is 433.12 g/mol.
Where can I buy 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)?
You can request a quote for 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dimethylamino)-1-phenylpyrrolidin-2-one--2,4,6-trinitrophenol (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.