DAP1_008953
TL;DR: DAP1_008953 (CAS 6062-14-2) is a chemical compound with molecular formula C33H33Cl2N3O8 and molecular weight 669.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6a,9a-dichloro-6-(4-hydroxy-3,5-dimethoxyphenyl)-8-methyl-2-(4-morpholin-4-ylphenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
Also Known As: DAP1_008953, 6a,9a-dichloro-6-(4-hydroxy-3,5-dimethoxyphenyl)-8-methyl-2-(4-morpholin-4-ylphenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone, 6a,9a-Dichloro-6-(4-hydroxy-3,5-dimethoxyphenyl)-8-methyl-2-[4-(morpholin-4-yl)phenyl]-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
| Molecular Formula | C33H33Cl2N3O8 |
|---|---|
| Molecular Weight | 669.16 g/mol |
| LogP | 3.4392 |
| Topological Polar Surface Area | 125.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 669.1645 |
| Heavy Atoms | 46 |
| Complexity | 1666.8611 |
Chemical Identifiers
| CAS Number | 6062-14-2 |
|---|---|
| SMILES | CN1C(=O)C2(CC3C4C(CC=C3C(C2(C1=O)Cl)C5=CC(=C(C(=C5)OC)O)OC)C(=O)N(C4=O)C6=CC=C(C=C6)N7CCOCC7)Cl |
Product Overview
DAP1_008953 (CAS 6062-14-2), with molecular formula C33H33Cl2N3O8 and molecular weight 669.16 g/mol. IUPAC: 6a,9a-dichloro-6-(4-hydroxy-3,5-dimethoxyphenyl)-8-methyl-2-(4-morpholin-4-ylphenyl)-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone.
Chemical Property Profile of DAP1_008953
Property Insights of DAP1_008953
The XLogP value of 3.4392 indicates that DAP1_008953 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.92 Ų falls within the moderate polarity range, balancing permeability and solubility for DAP1_008953. Following Lipinski's Rule of Five, DAP1_008953 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DAP1_008953?
The CAS number of DAP1_008953 is 6062-14-2.
What is the molecular formula of DAP1_008953?
The molecular formula of DAP1_008953 is C33H33Cl2N3O8.
What is the molecular weight of DAP1_008953?
The molecular weight of DAP1_008953 is 669.16 g/mol.
Where can I buy DAP1_008953?
You can request a quote for DAP1_008953 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DAP1_008953?
Yes, KEHONG BIO provides custom synthesis services for DAP1_008953 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.