DAP1_016984
TL;DR: DAP1_016984 (CAS 6070-17-3) is a chemical compound with molecular formula C38H29ClN2O7 and molecular weight 660.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-(3-chlorophenyl)-6-(2-hydroxynaphthalen-1-yl)-1,3,7,9-tetraoxo-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-2-carboxylate
Also Known As: DAP1_016984, Methyl 8-(3-chlorophenyl)-6-(2-hydroxynaphthalen-1-yl)-1,3,7,9-tetraoxo-6a-phenyl-3,3a,4,6,6a,7,8,9,9a,10,10a,10b-dodecahydroisoindolo[5,6-e]isoindole-2(1H)-carboxylate
| Molecular Formula | C38H29ClN2O7 |
|---|---|
| Molecular Weight | 660.17 g/mol |
| LogP | 6.1276 |
| Topological Polar Surface Area | 121.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 660.1663 |
| Heavy Atoms | 48 |
| Complexity | 2112.5588 |
Chemical Identifiers
| CAS Number | 6070-17-3 |
|---|---|
| SMILES | COC(=O)N1C(=O)C2CC=C3C(C2C1=O)CC4C(=O)N(C(=O)C4(C3C5=C(C=CC6=CC=CC=C65)O)C7=CC=CC=C7)C8=CC(=CC=C8)Cl |
Product Overview
DAP1_016984 (CAS 6070-17-3), with molecular formula C38H29ClN2O7 and molecular weight 660.17 g/mol. IUPAC: methyl 8-(3-chlorophenyl)-6-(2-hydroxynaphthalen-1-yl)-1,3,7,9-tetraoxo-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-2-carboxylate.
Chemical Property Profile of DAP1_016984
Property Insights of DAP1_016984
The XLogP value of 6.1276 indicates that DAP1_016984 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.29 Ų falls within the moderate polarity range, balancing permeability and solubility for DAP1_016984. Following Lipinski's Rule of Five, DAP1_016984 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DAP1_016984?
The CAS number of DAP1_016984 is 6070-17-3.
What is the molecular formula of DAP1_016984?
The molecular formula of DAP1_016984 is C38H29ClN2O7.
What is the molecular weight of DAP1_016984?
The molecular weight of DAP1_016984 is 660.17 g/mol.
Where can I buy DAP1_016984?
You can request a quote for DAP1_016984 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DAP1_016984?
Yes, KEHONG BIO provides custom synthesis services for DAP1_016984 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.