A2770/0117369
TL;DR: A2770/0117369 (CAS 433235-91-7) is a chemical compound with molecular formula C23H25N5O3 and molecular weight 419.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone
Also Known As: A2770/0117369, [4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone, 1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-(2-methylbenzoyl)piperazine, 4-[3-(3,5-dimethylpyrazolyl)-4-nitrophenyl]piperazinyl 2-methylphenyl ketone, {4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(2-methylphenyl)methanone
| Molecular Formula | C23H25N5O3 |
|---|---|
| Molecular Weight | 419.20 g/mol |
| LogP | 3.66816 |
| Topological Polar Surface Area | 84.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.19574 |
| Heavy Atoms | 31 |
| Complexity | 1145.8638 |
Chemical Identifiers
| CAS Number | 433235-91-7 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4C(=CC(=N4)C)C |
Product Overview
A2770/0117369 (CAS 433235-91-7), with molecular formula C23H25N5O3 and molecular weight 419.20 g/mol. IUPAC: [4-[3-(3,5-dimethylpyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone.
Chemical Property Profile of A2770/0117369
Property Insights of A2770/0117369
The XLogP value of 3.66816 indicates that A2770/0117369 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.51 Ų falls within the moderate polarity range, balancing permeability and solubility for A2770/0117369. Following Lipinski's Rule of Five, A2770/0117369 has 0 hydrogen bond donor(s) and 5 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 A2770/0117369?
The CAS number of A2770/0117369 is 433235-91-7.
What is the molecular formula of A2770/0117369?
The molecular formula of A2770/0117369 is C23H25N5O3.
What is the molecular weight of A2770/0117369?
The molecular weight of A2770/0117369 is 419.20 g/mol.
Where can I buy A2770/0117369?
You can request a quote for A2770/0117369 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2770/0117369?
Yes, KEHONG BIO provides custom synthesis services for A2770/0117369 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.