NCIOpen2_008325
TL;DR: NCIOpen2_008325 (CAS 4083-50-5) is a chemical compound with molecular formula C15H6ClF3N2O4 and molecular weight 370.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-7-nitro-9-oxofluoren-2-yl)-2,2,2-trifluoroacetamide
Also Known As: NCIOpen2_008325, N-(3-CHLORO-7-NITRO-9-OXO-9H-FLUOREN-2-YL)-2,2,2-TRIFLUOROACETAMIDE, N-(3-chloro-7-nitro-9-oxofluoren-2-yl)-2,2,2-trifluoroacetam, N-(3-chloro-7-nitro-9-oxofluoren-2-yl)-2,2,2-trifluoroacetamide, RefChem:357190
| Molecular Formula | C15H6ClF3N2O4 |
|---|---|
| Molecular Weight | 370.00 g/mol |
| LogP | 3.9604 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.99683 |
| Heavy Atoms | 25 |
| Complexity | 956.52313 |
Chemical Identifiers
| CAS Number | 4083-50-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C3=CC(=C(C=C23)Cl)NC(=O)C(F)(F)F |
Product Overview
NCIOpen2_008325 (CAS 4083-50-5), with molecular formula C15H6ClF3N2O4 and molecular weight 370.00 g/mol. IUPAC: N-(3-chloro-7-nitro-9-oxofluoren-2-yl)-2,2,2-trifluoroacetamide.
Chemical Property Profile of NCIOpen2_008325
Property Insights of NCIOpen2_008325
The XLogP value of 3.9604 indicates that NCIOpen2_008325 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for NCIOpen2_008325. Following Lipinski's Rule of Five, NCIOpen2_008325 has 1 hydrogen bond donor(s) and 4 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 NCIOpen2_008325?
The CAS number of NCIOpen2_008325 is 4083-50-5.
What is the molecular formula of NCIOpen2_008325?
The molecular formula of NCIOpen2_008325 is C15H6ClF3N2O4.
What is the molecular weight of NCIOpen2_008325?
The molecular weight of NCIOpen2_008325 is 370.00 g/mol.
Where can I buy NCIOpen2_008325?
You can request a quote for NCIOpen2_008325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_008325?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_008325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.