AS-871/43358606
TL;DR: AS-871/43358606 (CAS 879935-41-8) is a chemical compound with molecular formula C27H25N3O5 and molecular weight 471.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(3-hydroxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: AS-871/43358606, 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(3-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one, (3Z)-5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-hydroxyphenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(3-hydroxyphenyl)-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one, (3Z)-5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-hydroxyphenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one
| Molecular Formula | C27H25N3O5 |
|---|---|
| Molecular Weight | 471.18 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 471.1794 |
| Heavy Atoms | 35 |
| Complexity | 725.0 |
Chemical Identifiers
| CAS Number | 879935-41-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(C3=C(C2=O)NN=C3C4=CC=CC=C4O)C5=CC(=CC=C5)O)OC |
| InChIKey | BNFLLENUFLBETF-UHFFFAOYSA-N |
Product Overview
AS-871/43358606 (CAS 879935-41-8), with molecular formula C27H25N3O5 and molecular weight 471.18 g/mol. IUPAC: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4-(3-hydroxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of AS-871/43358606
Property Insights of AS-871/43358606
The XLogP value of 4.1 indicates that AS-871/43358606 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/43358606. Following Lipinski's Rule of Five, AS-871/43358606 has 3 hydrogen bond donor(s) and 6 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 AS-871/43358606?
The CAS number of AS-871/43358606 is 879935-41-8.
What is the molecular formula of AS-871/43358606?
The molecular formula of AS-871/43358606 is C27H25N3O5.
What is the molecular weight of AS-871/43358606?
The molecular weight of AS-871/43358606 is 471.18 g/mol.
Where can I buy AS-871/43358606?
You can request a quote for AS-871/43358606 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/43358606?
Yes, KEHONG BIO provides custom synthesis services for AS-871/43358606 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.