AN-988/40787762
TL;DR: AN-988/40787762 (CAS 439936-22-8) is a chemical compound with molecular formula C29H28ClNO6 and molecular weight 521.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[9-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]acetic acid
Also Known As: AN-988/40787762, (9-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-10(1H)-acridinyl)acetic acid, 2-[9-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]acetic acid, 2-(9-{4-[(4-CHLOROPHENYL)METHOXY]-3-METHOXYPHENYL}-1,8-DIOXO-1,2,3,4,5,6,7,8,9,10-DECAHYDROACRIDIN-10-YL)ACETIC ACID
| Molecular Formula | C29H28ClNO6 |
|---|---|
| Molecular Weight | 521.16 g/mol |
| LogP | 5.4256 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.1605 |
| Heavy Atoms | 37 |
| Complexity | 1282.4072 |
Chemical Identifiers
| CAS Number | 439936-22-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)N(C4=C2C(=O)CCC4)CC(=O)O)OCC5=CC=C(C=C5)Cl |
Product Overview
AN-988/40787762 (CAS 439936-22-8), with molecular formula C29H28ClNO6 and molecular weight 521.16 g/mol. IUPAC: 2-[9-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]acetic acid.
Chemical Property Profile of AN-988/40787762
Property Insights of AN-988/40787762
The XLogP value of 5.4256 indicates that AN-988/40787762 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-988/40787762. Following Lipinski's Rule of Five, AN-988/40787762 has 1 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 AN-988/40787762?
The CAS number of AN-988/40787762 is 439936-22-8.
What is the molecular formula of AN-988/40787762?
The molecular formula of AN-988/40787762 is C29H28ClNO6.
What is the molecular weight of AN-988/40787762?
The molecular weight of AN-988/40787762 is 521.16 g/mol.
Where can I buy AN-988/40787762?
You can request a quote for AN-988/40787762 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/40787762?
Yes, KEHONG BIO provides custom synthesis services for AN-988/40787762 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.