D132-0063
TL;DR: D132-0063 (CAS 898917-71-0) is a chemical compound with molecular formula C25H17ClO6 and molecular weight 448.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-chlorobenzoate
Also Known As: D132-0063, 6-(1,3-benzodioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl 4-chlorobenzoate, 6-(benzo[d][1,3]dioxol-5-yl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl 4-chlorobenzoate, [6-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-chlorobenzoate, 6-(2H-1,3-BENZODIOXOL-5-YL)-1,3-DIMETHYL-4-OXO-4H-CYCLOHEPTA[C]FURAN-8-YL 4-CHLOROBENZOATE
| Molecular Formula | C25H17ClO6 |
|---|---|
| Molecular Weight | 448.07 g/mol |
| LogP | 5.67814 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 448.07138 |
| Heavy Atoms | 32 |
| Complexity | 1436.0239 |
Chemical Identifiers
| CAS Number | 898917-71-0 |
|---|---|
| SMILES | CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC4=C(C=C3)OCO4)OC(=O)C5=CC=C(C=C5)Cl |
Product Overview
D132-0063 (CAS 898917-71-0), with molecular formula C25H17ClO6 and molecular weight 448.07 g/mol. IUPAC: [6-(1,3-benzodioxol-5-yl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-chlorobenzoate.
Chemical Property Profile of D132-0063
Property Insights of D132-0063
The XLogP value of 5.67814 indicates that D132-0063 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for D132-0063. Following Lipinski's Rule of Five, D132-0063 has 0 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 D132-0063?
The CAS number of D132-0063 is 898917-71-0.
What is the molecular formula of D132-0063?
The molecular formula of D132-0063 is C25H17ClO6.
What is the molecular weight of D132-0063?
The molecular weight of D132-0063 is 448.07 g/mol.
Where can I buy D132-0063?
You can request a quote for D132-0063 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D132-0063?
Yes, KEHONG BIO provides custom synthesis services for D132-0063 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.