AB00115929-01
TL;DR: AB00115929-01 (CAS 380558-03-2) is a chemical compound with molecular formula C23H24BrN3O4 and molecular weight 485.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione
Also Known As: AB00115929-01, 4-(4-bromobenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(pyridin-3-yl)-1H-pyrrol-2(5H)-one, 3-(4-bromobenzoyl)-4-hydroxy-1-(3-morpholinopropyl)-2-(3-pyridyl)-2H-pyrrol-5-one, (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione, 4-[(4-bromophenyl)carbonyl]-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(pyridin-3-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H24BrN3O4 |
|---|---|
| Molecular Weight | 485.10 g/mol |
| LogP | 2.9881 |
| Topological Polar Surface Area | 82.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.09503 |
| Heavy Atoms | 31 |
| Complexity | 972.0759 |
Chemical Identifiers
| CAS Number | 380558-03-2 |
|---|---|
| SMILES | C1COCCN1CCCN2C(/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C2=O)C4=CN=CC=C4 |
Product Overview
AB00115929-01 (CAS 380558-03-2), with molecular formula C23H24BrN3O4 and molecular weight 485.10 g/mol. IUPAC: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-1-(3-morpholin-4-ylpropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione.
Chemical Property Profile of AB00115929-01
Property Insights of AB00115929-01
The XLogP value of 2.9881 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00115929-01. The TPSA of 82.97 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00115929-01. Following Lipinski's Rule of Five, AB00115929-01 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 AB00115929-01?
The CAS number of AB00115929-01 is 380558-03-2.
What is the molecular formula of AB00115929-01?
The molecular formula of AB00115929-01 is C23H24BrN3O4.
What is the molecular weight of AB00115929-01?
The molecular weight of AB00115929-01 is 485.10 g/mol.
Where can I buy AB00115929-01?
You can request a quote for AB00115929-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00115929-01?
Yes, KEHONG BIO provides custom synthesis services for AB00115929-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.