DAP1_007399
TL;DR: DAP1_007399 (CAS 6060-58-8) is a chemical compound with molecular formula C22H20Cl2N2O5 and molecular weight 462.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6a,9a-dichloro-6-(3-hydroxyphenyl)-2,8-dimethyl-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone
Also Known As: DAP1_007399, 6a,9a-dichloro-6-(3-hydroxyphenyl)-2,8-dimethyl-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone, 6a,9a-Dichloro-6-(3-hydroxyphenyl)-2,8-dimethyl-3a,4,6,6a,9a,10,10a,10b-octahydroisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
| Molecular Formula | C22H20Cl2N2O5 |
|---|---|
| Molecular Weight | 462.07 g/mol |
| LogP | 2.0106 |
| Topological Polar Surface Area | 94.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 462.07492 |
| Heavy Atoms | 31 |
| Complexity | 1103.1271 |
Chemical Identifiers
| CAS Number | 6060-58-8 |
|---|---|
| SMILES | CN1C(=O)C2CC=C3C(C2C1=O)CC4(C(=O)N(C(=O)C4(C3C5=CC(=CC=C5)O)Cl)C)Cl |
Product Overview
DAP1_007399 (CAS 6060-58-8), with molecular formula C22H20Cl2N2O5 and molecular weight 462.07 g/mol. IUPAC: 6a,9a-dichloro-6-(3-hydroxyphenyl)-2,8-dimethyl-3a,4,6,10,10a,10b-hexahydroisoindolo[5,6-e]isoindole-1,3,7,9-tetrone.
Chemical Property Profile of DAP1_007399
Property Insights of DAP1_007399
The XLogP value of 2.0106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DAP1_007399. The TPSA of 94.99 Ų falls within the moderate polarity range, balancing permeability and solubility for DAP1_007399. Following Lipinski's Rule of Five, DAP1_007399 has 1 hydrogen bond donor(s) and 5 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 DAP1_007399?
The CAS number of DAP1_007399 is 6060-58-8.
What is the molecular formula of DAP1_007399?
The molecular formula of DAP1_007399 is C22H20Cl2N2O5.
What is the molecular weight of DAP1_007399?
The molecular weight of DAP1_007399 is 462.07 g/mol.
Where can I buy DAP1_007399?
You can request a quote for DAP1_007399 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DAP1_007399?
Yes, KEHONG BIO provides custom synthesis services for DAP1_007399 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.