AB00117688-01
TL;DR: AB00117688-01 (CAS 432011-24-0) is a chemical compound with molecular formula C22H23N3O5 and molecular weight 409.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(4-methylphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: AB00117688-01, 1-(2-(dimethylamino)ethyl)-3-hydroxy-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one, (4E)-1-(2-dimethylaminoethyl)-4-[hydroxy-(4-methylphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione, 1-[2-(dimethylamino)ethyl]-3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C22H23N3O5 |
|---|---|
| Molecular Weight | 409.16 g/mol |
| LogP | 2.88652 |
| Topological Polar Surface Area | 103.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.16376 |
| Heavy Atoms | 30 |
| Complexity | 1027.3235 |
Chemical Identifiers
| CAS Number | 432011-24-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)[N+](=O)[O-])/O |
Product Overview
AB00117688-01 (CAS 432011-24-0), with molecular formula C22H23N3O5 and molecular weight 409.16 g/mol. IUPAC: (4E)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(4-methylphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AB00117688-01
Property Insights of AB00117688-01
The XLogP value of 2.88652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00117688-01. The TPSA of 103.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117688-01. Following Lipinski's Rule of Five, AB00117688-01 has 1 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 AB00117688-01?
The CAS number of AB00117688-01 is 432011-24-0.
What is the molecular formula of AB00117688-01?
The molecular formula of AB00117688-01 is C22H23N3O5.
What is the molecular weight of AB00117688-01?
The molecular weight of AB00117688-01 is 409.16 g/mol.
Where can I buy AB00117688-01?
You can request a quote for AB00117688-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117688-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117688-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.