A3560/0151017
TL;DR: A3560/0151017 (CAS 1087762-92-2) is a chemical compound with molecular formula C18H12N4O5 and molecular weight 364.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoyl-5-(4-nitrophenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione
Also Known As: A3560/0151017, 3-benzoyl-5-(4-nitrophenyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione, 3-benzoyl-5-(4-nitrophenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione, 3-BENZOYL-5-(4-NITROPHENYL)-3A,6A-DIHYDROPYRROLO[3,4-C]PYRAZOLE-4,6(1H,5H)-DIONE, 5-(4-nitrophenyl)-3-(phenylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
| Molecular Formula | C18H12N4O5 |
|---|---|
| Molecular Weight | 364.08 g/mol |
| LogP | 1.2949 |
| Topological Polar Surface Area | 121.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.08078 |
| Heavy Atoms | 27 |
| Complexity | 1000.1719 |
Chemical Identifiers
| CAS Number | 1087762-92-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=NNC3C2C(=O)N(C3=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
A3560/0151017 (CAS 1087762-92-2), with molecular formula C18H12N4O5 and molecular weight 364.08 g/mol. IUPAC: 3-benzoyl-5-(4-nitrophenyl)-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-4,6-dione.
Chemical Property Profile of A3560/0151017
Property Insights of A3560/0151017
The XLogP value of 1.2949 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3560/0151017. The TPSA of 121.98 Ų falls within the moderate polarity range, balancing permeability and solubility for A3560/0151017. Following Lipinski's Rule of Five, A3560/0151017 has 1 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 A3560/0151017?
The CAS number of A3560/0151017 is 1087762-92-2.
What is the molecular formula of A3560/0151017?
The molecular formula of A3560/0151017 is C18H12N4O5.
What is the molecular weight of A3560/0151017?
The molecular weight of A3560/0151017 is 364.08 g/mol.
Where can I buy A3560/0151017?
You can request a quote for A3560/0151017 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3560/0151017?
Yes, KEHONG BIO provides custom synthesis services for A3560/0151017 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.