DAP1_017954
TL;DR: DAP1_017954 (CAS 6071-14-3) is a chemical compound with molecular formula C34H27Cl2FN4O7 and molecular weight 692.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2,4-dichloroanilino)-6-(3-fluoro-4-hydroxyphenyl)-6a-(4-methoxyphenyl)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-2-carboxamide
Also Known As: DAP1_017954, 8-(2,4-Dichloroanilino)-6-(3-fluoro-4-hydroxyphenyl)-6a-(4-methoxyphenyl)-1,3,7,9-tetraoxo-3,3a,4,6,6a,7,8,9,9a,10,10a,10b-dodecahydroisoindolo[5,6-e]isoindole-2(1H)-carboxamide
| Molecular Formula | C34H27Cl2FN4O7 |
|---|---|
| Molecular Weight | 692.12 g/mol |
| LogP | 4.9103 |
| Topological Polar Surface Area | 159.34 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 692.1241 |
| Heavy Atoms | 48 |
| Complexity | 1970.8193 |
Chemical Identifiers
| CAS Number | 6071-14-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C23C(CC4C5C(CC=C4C2C6=CC(=C(C=C6)O)F)C(=O)N(C5=O)C(=O)N)C(=O)N(C3=O)NC7=C(C=C(C=C7)Cl)Cl |
Product Overview
DAP1_017954 (CAS 6071-14-3), with molecular formula C34H27Cl2FN4O7 and molecular weight 692.12 g/mol. IUPAC: 8-(2,4-dichloroanilino)-6-(3-fluoro-4-hydroxyphenyl)-6a-(4-methoxyphenyl)-1,3,7,9-tetraoxo-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-2-carboxamide.
Chemical Property Profile of DAP1_017954
Property Insights of DAP1_017954
The XLogP value of 4.9103 indicates that DAP1_017954 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.34 Ų indicates high polarity, suggesting DAP1_017954 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DAP1_017954 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DAP1_017954?
The CAS number of DAP1_017954 is 6071-14-3.
What is the molecular formula of DAP1_017954?
The molecular formula of DAP1_017954 is C34H27Cl2FN4O7.
What is the molecular weight of DAP1_017954?
The molecular weight of DAP1_017954 is 692.12 g/mol.
Where can I buy DAP1_017954?
You can request a quote for DAP1_017954 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DAP1_017954?
Yes, KEHONG BIO provides custom synthesis services for DAP1_017954 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.