BAS 00792603
TL;DR: BAS 00792603 (CAS 324052-40-6) is a chemical compound with molecular formula C22H13N3O9 and molecular weight 463.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (9E)-9-[(2-hydroxyphenyl)methylidene]-2,5,7-trinitrofluorene-4-carboxylate
Also Known As: BAS 00792603, methyl (9E)-9-[(2-hydroxyphenyl)methylidene]-2,5,7-trinitrofluorene-4-carboxylate, (E)-methyl 9-(2-hydroxybenzylidene)-2,5,7-trinitro-9H-fluorene-4-carboxylate, 9-(2-HO-BENZYLIDENE)-2,5,7-TRINITRO-9H-FLUORENE-4-CARBOXYLIC ACID METHYL ESTER, methyl (9E)-9-(2-hydroxybenzylidene)-2,5,7-trinitro-9H-fluorene-4-carboxylate
| Molecular Formula | C22H13N3O9 |
|---|---|
| Molecular Weight | 463.07 g/mol |
| LogP | 4.4727 |
| Topological Polar Surface Area | 175.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.0652 |
| Heavy Atoms | 34 |
| Complexity | 1460.2147 |
Chemical Identifiers
| CAS Number | 324052-40-6 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC\2=C1C3=C(/C2=C/C4=CC=CC=C4O)C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
BAS 00792603 (CAS 324052-40-6), with molecular formula C22H13N3O9 and molecular weight 463.07 g/mol. IUPAC: methyl (9E)-9-[(2-hydroxyphenyl)methylidene]-2,5,7-trinitrofluorene-4-carboxylate.
Chemical Property Profile of BAS 00792603
Property Insights of BAS 00792603
The XLogP value of 4.4727 indicates that BAS 00792603 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 175.95 Ų indicates high polarity, suggesting BAS 00792603 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00792603 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 BAS 00792603?
The CAS number of BAS 00792603 is 324052-40-6.
What is the molecular formula of BAS 00792603?
The molecular formula of BAS 00792603 is C22H13N3O9.
What is the molecular weight of BAS 00792603?
The molecular weight of BAS 00792603 is 463.07 g/mol.
Where can I buy BAS 00792603?
You can request a quote for BAS 00792603 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00792603?
Yes, KEHONG BIO provides custom synthesis services for BAS 00792603 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.