DAP1_005651
TL;DR: DAP1_005651 (CAS 6058-84-0) is a chemical compound with molecular formula C29H21Cl2F5N2O6 and molecular weight 658.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6a,9a-dichloro-6-(3-ethoxy-2-hydroxyphenyl)-2-methyl-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
Also Known As: DAP1_005651, 6a,9a-Dichloro-6-(3-ethoxy-2-hydroxyphenyl)-2-methyl-8-(pentafluorophenyl)-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
| Molecular Formula | C29H21Cl2F5N2O6 |
|---|---|
| Molecular Weight | 658.07 g/mol |
| LogP | 4.6796 |
| Topological Polar Surface Area | 104.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 658.0697 |
| Heavy Atoms | 44 |
| Complexity | 1708.9904 |
Chemical Identifiers
| CAS Number | 6058-84-0 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1O)C2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=C(C(=C(C(=C6F)F)F)F)F)Cl)Cl)C(=O)N(C4=O)C |
Product Overview
DAP1_005651 (CAS 6058-84-0), with molecular formula C29H21Cl2F5N2O6 and molecular weight 658.07 g/mol. IUPAC: 6a,9a-dichloro-6-(3-ethoxy-2-hydroxyphenyl)-2-methyl-8-(2,3,4,5,6-pentafluorophenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone.
Chemical Property Profile of DAP1_005651
Property Insights of DAP1_005651
The XLogP value of 4.6796 indicates that DAP1_005651 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.22 Ų falls within the moderate polarity range, balancing permeability and solubility for DAP1_005651. Following Lipinski's Rule of Five, DAP1_005651 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DAP1_005651?
The CAS number of DAP1_005651 is 6058-84-0.
What is the molecular formula of DAP1_005651?
The molecular formula of DAP1_005651 is C29H21Cl2F5N2O6.
What is the molecular weight of DAP1_005651?
The molecular weight of DAP1_005651 is 658.07 g/mol.
Where can I buy DAP1_005651?
You can request a quote for DAP1_005651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DAP1_005651?
Yes, KEHONG BIO provides custom synthesis services for DAP1_005651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.