ChemDiv1_019369
TL;DR: ChemDiv1_019369 (CAS 313259-40-4) is a chemical compound with molecular formula C27H19F3N2O3 and molecular weight 476.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide
Also Known As: ChemDiv1_019369, RCL R457779, BAS 00341022, A1263/0057770, N-((12,14-dioxo-11,12,14,15-tetrahydro-9H-9,10-[3,4]epipyrroloanthracen-13(10H)-yl)methyl)-2,2,2-trifluoro-N-phenylacetamide
| Molecular Formula | C27H19F3N2O3 |
|---|---|
| Molecular Weight | 476.13 g/mol |
| LogP | 4.4316 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 476.13477 |
| Heavy Atoms | 35 |
| Complexity | 1255.8394 |
Chemical Identifiers
| CAS Number | 313259-40-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CN2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46)C(=O)C(F)(F)F |
Product Overview
ChemDiv1_019369 (CAS 313259-40-4), with molecular formula C27H19F3N2O3 and molecular weight 476.13 g/mol. IUPAC: N-[(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)methyl]-2,2,2-trifluoro-N-phenylacetamide.
Chemical Property Profile of ChemDiv1_019369
Property Insights of ChemDiv1_019369
The XLogP value of 4.4316 indicates that ChemDiv1_019369 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, ChemDiv1_019369 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_019369 has 0 hydrogen bond donor(s) and 3 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 ChemDiv1_019369?
The CAS number of ChemDiv1_019369 is 313259-40-4.
What is the molecular formula of ChemDiv1_019369?
The molecular formula of ChemDiv1_019369 is C27H19F3N2O3.
What is the molecular weight of ChemDiv1_019369?
The molecular weight of ChemDiv1_019369 is 476.13 g/mol.
Where can I buy ChemDiv1_019369?
You can request a quote for ChemDiv1_019369 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019369?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019369 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.