AB00117139-01
TL;DR: AB00117139-01 (CAS 371117-18-9) is a chemical compound with molecular formula C23H25N3O6 and molecular weight 439.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Also Known As: AB00117139-01, (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione, 1-(3-(dimethylamino)propyl)-3-hydroxy-4-(4-methoxybenzoyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one, 1-[3-(dimethylamino)propyl]-3-hydroxy-4-(4-methoxybenzoyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one, 1-[3-(dimethylamino)propyl]-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H25N3O6 |
|---|---|
| Molecular Weight | 439.17 g/mol |
| LogP | 2.9768 |
| Topological Polar Surface Area | 113.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 439.17435 |
| Heavy Atoms | 32 |
| Complexity | 1061.6564 |
Chemical Identifiers
| CAS Number | 371117-18-9 |
|---|---|
| SMILES | CN(C)CCCN1C(/C(=C(/C2=CC=C(C=C2)OC)\O)/C(=O)C1=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
AB00117139-01 (CAS 371117-18-9), with molecular formula C23H25N3O6 and molecular weight 439.17 g/mol. IUPAC: (4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AB00117139-01
Property Insights of AB00117139-01
The XLogP value of 2.9768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00117139-01. The TPSA of 113.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117139-01. Following Lipinski's Rule of Five, AB00117139-01 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 AB00117139-01?
The CAS number of AB00117139-01 is 371117-18-9.
What is the molecular formula of AB00117139-01?
The molecular formula of AB00117139-01 is C23H25N3O6.
What is the molecular weight of AB00117139-01?
The molecular weight of AB00117139-01 is 439.17 g/mol.
Where can I buy AB00117139-01?
You can request a quote for AB00117139-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117139-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117139-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.