A1893/0079473
TL;DR: A1893/0079473 (CAS 312499-74-4) is a chemical compound with molecular formula C28H22N4O6 and molecular weight 510.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: A1893/0079473, (4E)-1-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione, (4E)-1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione
| Molecular Formula | C28H22N4O6 |
|---|---|
| Molecular Weight | 510.15 g/mol |
| LogP | 4.01892 |
| Topological Polar Surface Area | 127.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 510.15393 |
| Heavy Atoms | 38 |
| Complexity | 1668.2589 |
Chemical Identifiers
| CAS Number | 312499-74-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(/C(=C(/C4=CC=CC=C4)\O)/C(=O)C3=O)C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
A1893/0079473 (CAS 312499-74-4), with molecular formula C28H22N4O6 and molecular weight 510.15 g/mol. IUPAC: (4E)-1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of A1893/0079473
Property Insights of A1893/0079473
The XLogP value of 4.01892 indicates that A1893/0079473 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.68 Ų falls within the moderate polarity range, balancing permeability and solubility for A1893/0079473. Following Lipinski's Rule of Five, A1893/0079473 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1893/0079473?
The CAS number of A1893/0079473 is 312499-74-4.
What is the molecular formula of A1893/0079473?
The molecular formula of A1893/0079473 is C28H22N4O6.
What is the molecular weight of A1893/0079473?
The molecular weight of A1893/0079473 is 510.15 g/mol.
Where can I buy A1893/0079473?
You can request a quote for A1893/0079473 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1893/0079473?
Yes, KEHONG BIO provides custom synthesis services for A1893/0079473 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.