AB01306347-01
TL;DR: AB01306347-01 (CAS 879964-00-8) is a chemical compound with molecular formula C28H28N4O4 and molecular weight 484.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-ethoxy-3-methoxyphenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(pyridin-3-ylmethyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
Also Known As: AB01306347-01, 4-(4-ethoxy-3-methoxyphenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one, (3Z)-3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-ethoxy-3-methoxyphenyl)-5-(pyridin-3-ylmethyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(4-ethoxy-3-methoxyphenyl)-5-(pyridin-3-ylmethyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one, 4-(4-ethoxy-3-methoxyphenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(pyridin-3-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
| Molecular Formula | C28H28N4O4 |
|---|---|
| Molecular Weight | 484.21 g/mol |
| LogP | 4.94684 |
| Topological Polar Surface Area | 100.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.21106 |
| Heavy Atoms | 36 |
| Complexity | 1431.2429 |
Chemical Identifiers
| CAS Number | 879964-00-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2C3=C(C(=O)N2CC4=CN=CC=C4)NN=C3C5=CC(=CC(=C5O)C)C)OC |
Product Overview
AB01306347-01 (CAS 879964-00-8), with molecular formula C28H28N4O4 and molecular weight 484.21 g/mol. IUPAC: 4-(4-ethoxy-3-methoxyphenyl)-3-(2-hydroxy-3,5-dimethylphenyl)-5-(pyridin-3-ylmethyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.
Chemical Property Profile of AB01306347-01
Property Insights of AB01306347-01
The XLogP value of 4.94684 indicates that AB01306347-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.57 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01306347-01. Following Lipinski's Rule of Five, AB01306347-01 has 2 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 AB01306347-01?
The CAS number of AB01306347-01 is 879964-00-8.
What is the molecular formula of AB01306347-01?
The molecular formula of AB01306347-01 is C28H28N4O4.
What is the molecular weight of AB01306347-01?
The molecular weight of AB01306347-01 is 484.21 g/mol.
Where can I buy AB01306347-01?
You can request a quote for AB01306347-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01306347-01?
Yes, KEHONG BIO provides custom synthesis services for AB01306347-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.