A3466/0146974
TL;DR: A3466/0146974 (CAS 696646-75-0) is a chemical compound with molecular formula C28H28N4O2 and molecular weight 452.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-amino-1'-(4-ethylphenyl)-5,7',7'-trimethyl-2,5'-dioxospiro[1H-indole-3,4'-6,8-dihydroquinoline]-3'-carbonitrile
Also Known As: A3466/0146974, 2'-amino-1'-(4-ethylphenyl)-5,7',7'-trimethyl-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile, 2'-Amino-1'-(4-ethylphenyl)-1,2,5',6',7',8'-hexahydro-5,7',7'-trimethyl-2,5'-dioxospiro[3H-indole-3,4'(1'H)-quinoline]-3'-carbonitrile, 2'-amino-1'-(4-ethylphenyl)-5,7',7'-trimethyl-2,5'-dioxospiro[1H-indole-3,4'-6,8-dihydroquinoline]-3'-carbonitrile, 2a(2)-Amino-1a(2)-(4-ethylphenyl)-1,2,5a(2),6a(2),7a(2),8a(2)-hexahydro-5,7a(2),7a(2)-trimethyl-2,5a(2)-dioxospiro[3H-indole-3,4a(2)(1a(2)H)-quinoline]-3a(2)-carbonitrile
| Molecular Formula | C28H28N4O2 |
|---|---|
| Molecular Weight | 452.22 g/mol |
| LogP | 4.6046 |
| Topological Polar Surface Area | 99.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 452.22122 |
| Heavy Atoms | 34 |
| Complexity | 1357.7653 |
Chemical Identifiers
| CAS Number | 696646-75-0 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C3=C(C(=O)CC(C3)(C)C)C4(C5=C(C=CC(=C5)C)NC4=O)C(=C2N)C#N |
Product Overview
A3466/0146974 (CAS 696646-75-0), with molecular formula C28H28N4O2 and molecular weight 452.22 g/mol. IUPAC: 2'-amino-1'-(4-ethylphenyl)-5,7',7'-trimethyl-2,5'-dioxospiro[1H-indole-3,4'-6,8-dihydroquinoline]-3'-carbonitrile.
Chemical Property Profile of A3466/0146974
Property Insights of A3466/0146974
The XLogP value of 4.6046 indicates that A3466/0146974 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.22 Ų falls within the moderate polarity range, balancing permeability and solubility for A3466/0146974. Following Lipinski's Rule of Five, A3466/0146974 has 2 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 A3466/0146974?
The CAS number of A3466/0146974 is 696646-75-0.
What is the molecular formula of A3466/0146974?
The molecular formula of A3466/0146974 is C28H28N4O2.
What is the molecular weight of A3466/0146974?
The molecular weight of A3466/0146974 is 452.22 g/mol.
Where can I buy A3466/0146974?
You can request a quote for A3466/0146974 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3466/0146974?
Yes, KEHONG BIO provides custom synthesis services for A3466/0146974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.