NCIOpen2_007473
TL;DR: NCIOpen2_007473 (CAS 2341-42-6) is a chemical compound with molecular formula C19H13F3N2O4 and molecular weight 390.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-[[9-[(2,2,2-trifluoroacetyl)amino]-9H-fluoren-2-yl]amino]but-2-enoic acid
Also Known As: NCIOpen2_007473, Maleamic acid,N-[9-(2,2,2-trifluoroacetamido)fluoren-2-yl]- (6CI,8CI), 4-oxo-4-[[9-[(2,2,2-trifluoroacetyl)amino]-9H-fluoren-2-yl]amino]but-2-enoic acid
| Molecular Formula | C19H13F3N2O4 |
|---|---|
| Molecular Weight | 390.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.08273 |
| Heavy Atoms | 28 |
| Complexity | 664.0 |
Chemical Identifiers
| CAS Number | 2341-42-6 |
|---|---|
| SMILES | C1=CC=C2C3=C(C=C(C=C3)NC(=O)C=CC(=O)O)C(C2=C1)NC(=O)C(F)(F)F |
| InChIKey | XYHFOCVVLDYSPO-UHFFFAOYSA-N |
Product Overview
NCIOpen2_007473 (CAS 2341-42-6), with molecular formula C19H13F3N2O4 and molecular weight 390.08 g/mol. IUPAC: 4-oxo-4-[[9-[(2,2,2-trifluoroacetyl)amino]-9H-fluoren-2-yl]amino]but-2-enoic acid.
Chemical Property Profile of NCIOpen2_007473
Property Insights of NCIOpen2_007473
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NCIOpen2_007473. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for NCIOpen2_007473. Following Lipinski's Rule of Five, NCIOpen2_007473 has 3 hydrogen bond donor(s) and 7 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_007473?
The CAS number of NCIOpen2_007473 is 2341-42-6.
What is the molecular formula of NCIOpen2_007473?
The molecular formula of NCIOpen2_007473 is C19H13F3N2O4.
What is the molecular weight of NCIOpen2_007473?
The molecular weight of NCIOpen2_007473 is 390.08 g/mol.
Where can I buy NCIOpen2_007473?
You can request a quote for NCIOpen2_007473 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_007473?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_007473 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.