(trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate
TL;DR: (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate (CAS 5301-32-6) is a chemical compound with molecular formula C30H32N6O6 and molecular weight 572.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenylpyrrolidin-2-one;5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
Also Known As: (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate, 2-Pyrrolidinone, 5-methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-, picrolonate, (E)-, 2-Pyrrolidinone, 5-methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-, picrolonate, (Z)-, (3R,5R)-5-Methyl-3-[methyl(2-phenylethyl)amino]-1-phenylpyrrolidin-2-one--5-methyl-4-nitro-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one (1/1), (3R,5R)-5-methyl-3-[methyl(phenethyl)amino]-1-phenylpyrrolidin-2-one; 5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one
| Molecular Formula | C30H32N6O6 |
|---|---|
| Molecular Weight | 572.24 g/mol |
| LogP | 4.3175 |
| Topological Polar Surface Area | 142.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 572.23834 |
| Heavy Atoms | 42 |
| Complexity | 1464.6244 |
Chemical Identifiers
| CAS Number | 5301-32-6 |
|---|---|
| SMILES | C[C@@H]1C[C@H](C(=O)N1C2=CC=CC=C2)N(C)CCC3=CC=CC=C3.CC1=NN(C(=O)C1[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
(trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate (CAS 5301-32-6), with molecular formula C30H32N6O6 and molecular weight 572.24 g/mol. IUPAC: (3R,5R)-5-methyl-3-[methyl(2-phenylethyl)amino]-1-phenylpyrrolidin-2-one;5-methyl-4-nitro-2-(4-nitrophenyl)-4H-pyrazol-3-one.
Chemical Property Profile of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate
Property Insights of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate
The XLogP value of 4.3175 indicates that (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.5 Ų indicates high polarity, suggesting (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate?
The CAS number of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate is 5301-32-6.
What is the molecular formula of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate?
The molecular formula of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate is C30H32N6O6.
What is the molecular weight of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate?
The molecular weight of (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate is 572.24 g/mol.
Where can I buy (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate?
You can request a quote for (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate?
Yes, KEHONG BIO provides custom synthesis services for (trans)-5-Methyl-3-(N-methyl-N-phenethylamino)-1-phenyl-2-pyrrolidinone picrolonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.