DAP1_006380
TL;DR: DAP1_006380 (CAS 6059-56-9) is a chemical compound with molecular formula C35H27Cl2FN2O6 and molecular weight 660.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6a,9a-dichloro-2-(4-ethenylphenyl)-8-(4-fluorophenyl)-6-(2-hydroxy-5-methoxyphenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
Also Known As: DAP1_006380, 6a,9a-Dichloro-2-(4-ethenylphenyl)-8-(4-fluorophenyl)-6-(2-hydroxy-5-methoxyphenyl)-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
| Molecular Formula | C35H27Cl2FN2O6 |
|---|---|
| Molecular Weight | 660.12 g/mol |
| LogP | 5.9509 |
| Topological Polar Surface Area | 104.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 660.12305 |
| Heavy Atoms | 46 |
| Complexity | 1878.4901 |
Chemical Identifiers
| CAS Number | 6059-56-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)O)C2C3=CCC4C(C3CC5(C2(C(=O)N(C5=O)C6=CC=C(C=C6)F)Cl)Cl)C(=O)N(C4=O)C7=CC=C(C=C7)C=C |
Product Overview
DAP1_006380 (CAS 6059-56-9), with molecular formula C35H27Cl2FN2O6 and molecular weight 660.12 g/mol. IUPAC: 6a,9a-dichloro-2-(4-ethenylphenyl)-8-(4-fluorophenyl)-6-(2-hydroxy-5-methoxyphenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone.
Chemical Property Profile of DAP1_006380
Property Insights of DAP1_006380
The XLogP value of 5.9509 indicates that DAP1_006380 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_006380. Following Lipinski's Rule of Five, DAP1_006380 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_006380?
The CAS number of DAP1_006380 is 6059-56-9.
What is the molecular formula of DAP1_006380?
The molecular formula of DAP1_006380 is C35H27Cl2FN2O6.
What is the molecular weight of DAP1_006380?
The molecular weight of DAP1_006380 is 660.12 g/mol.
Where can I buy DAP1_006380?
You can request a quote for DAP1_006380 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DAP1_006380?
Yes, KEHONG BIO provides custom synthesis services for DAP1_006380 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.