C27H22N2O8
TL;DR: C27H22N2O8 (CAS 488731-90-4) is a chemical compound with molecular formula C27H22N2O8 and molecular weight 502.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]benzoate
| Molecular Formula | C27H22N2O8 |
|---|---|
| Molecular Weight | 502.14 g/mol |
| LogP | 4.4064 |
| Topological Polar Surface Area | 136.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 502.1376 |
| Heavy Atoms | 37 |
| Complexity | 1393.8285 |
Chemical Identifiers
| CAS Number | 488731-90-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(/C(=C(/C3=CC=C(C=C3)[N+](=O)[O-])\O)/C(=O)C2=O)C4=CC=C(C=C4)OC |
Product Overview
C27H22N2O8 (CAS 488731-90-4), with molecular formula C27H22N2O8 and molecular weight 502.14 g/mol. IUPAC: ethyl 4-[(3E)-3-[hydroxy-(4-nitrophenyl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of C27H22N2O8
Property Insights of C27H22N2O8
The XLogP value of 4.4064 indicates that C27H22N2O8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.28 Ų falls within the moderate polarity range, balancing permeability and solubility for C27H22N2O8. Following Lipinski's Rule of Five, C27H22N2O8 has 1 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 C27H22N2O8?
The CAS number of C27H22N2O8 is 488731-90-4.
What is the molecular formula of C27H22N2O8?
The molecular formula of C27H22N2O8 is C27H22N2O8.
What is the molecular weight of C27H22N2O8?
The molecular weight of C27H22N2O8 is 502.14 g/mol.
Where can I buy C27H22N2O8?
You can request a quote for C27H22N2O8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H22N2O8?
Yes, KEHONG BIO provides custom synthesis services for C27H22N2O8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.