ChemDiv1_023787
TL;DR: ChemDiv1_023787 (CAS 473800-75-8) is a chemical compound with molecular formula C31H30N2O4 and molecular weight 494.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-N-(4-methoxyphenyl)hexanamide
Also Known As: ChemDiv1_023787, BAS 02800562, 2-(12,14-dioxo-11,12,14,15-tetrahydro-9H-9,10-[3,4]epipyrroloanthracen-13(10H)-yl)-N-(4-methoxyphenyl)hexanamide, 2-(16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-N-(4-methoxyphenyl)hexanamide, 2-(16,18-dioxo-17-azapentacyclo[6.6.5.0<2,7>.0<9,14>.0<15,19>]nonadeca-2(7),3, 5,9(14),10,12-hexaen-17-yl)-N-(4-methoxyphenyl)hexanamide
| Molecular Formula | C31H30N2O4 |
|---|---|
| Molecular Weight | 494.22 g/mol |
| LogP | 5.0847 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.22055 |
| Heavy Atoms | 37 |
| Complexity | 1266.4652 |
Chemical Identifiers
| CAS Number | 473800-75-8 |
|---|---|
| SMILES | CCCCC(C(=O)NC1=CC=C(C=C1)OC)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46 |
Product Overview
ChemDiv1_023787 (CAS 473800-75-8), with molecular formula C31H30N2O4 and molecular weight 494.22 g/mol. IUPAC: 2-(16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)-N-(4-methoxyphenyl)hexanamide.
Chemical Property Profile of ChemDiv1_023787
Property Insights of ChemDiv1_023787
The XLogP value of 5.0847 indicates that ChemDiv1_023787 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_023787. Following Lipinski's Rule of Five, ChemDiv1_023787 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_023787?
The CAS number of ChemDiv1_023787 is 473800-75-8.
What is the molecular formula of ChemDiv1_023787?
The molecular formula of ChemDiv1_023787 is C31H30N2O4.
What is the molecular weight of ChemDiv1_023787?
The molecular weight of ChemDiv1_023787 is 494.22 g/mol.
Where can I buy ChemDiv1_023787?
You can request a quote for ChemDiv1_023787 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023787?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023787 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.