AB01289294-01
TL;DR: AB01289294-01 (CAS 880391-63-9) is a chemical compound with molecular formula C22H23N3O6 and molecular weight 425.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-hydroxyethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: AB01289294-01, 5-(2-hydroxyethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one, (3Z)-5-(2-hydroxyethyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-(3,4,5-trimethoxyphenyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 5-(2-hydroxyethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one, 5-(2-hydroxyethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
| Molecular Formula | C22H23N3O6 |
|---|---|
| Molecular Weight | 425.16 g/mol |
| LogP | 2.3456 |
| Topological Polar Surface Area | 117.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.1587 |
| Heavy Atoms | 31 |
| Complexity | 1101.1792 |
Chemical Identifiers
| CAS Number | 880391-63-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2C3=C(C(=O)N2CCO)NN=C3C4=CC=CC=C4O |
Product Overview
AB01289294-01 (CAS 880391-63-9), with molecular formula C22H23N3O6 and molecular weight 425.16 g/mol. IUPAC: 5-(2-hydroxyethyl)-3-(2-hydroxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of AB01289294-01
Property Insights of AB01289294-01
The XLogP value of 2.3456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01289294-01. The TPSA of 117.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01289294-01. Following Lipinski's Rule of Five, AB01289294-01 has 3 hydrogen bond donor(s) and 7 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 AB01289294-01?
The CAS number of AB01289294-01 is 880391-63-9.
What is the molecular formula of AB01289294-01?
The molecular formula of AB01289294-01 is C22H23N3O6.
What is the molecular weight of AB01289294-01?
The molecular weight of AB01289294-01 is 425.16 g/mol.
Where can I buy AB01289294-01?
You can request a quote for AB01289294-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01289294-01?
Yes, KEHONG BIO provides custom synthesis services for AB01289294-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.