methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
TL;DR: methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate (CAS 630064-39-0) is a chemical compound with molecular formula C28H32N4O5 and molecular weight 504.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(3E)-1-[3-(diethylamino)propyl]-3-[hydroxy-(2-methylimidazo[1,2-a]pyridin-3-yl)methylidene]-4,5-dioxopyrrolidin-2-yl]benzoate
Also Known As: methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate, methyl 4-[(3E)-1-[3-(diethylamino)propyl]-3-[hydroxy-(2-methylimidazo[1,2-a]pyridin-3-yl)methylidene]-4,5-dioxopyrrolidin-2-yl]benzoate, methyl 4-{1-[3-(diethylamino)propyl]-4-hydroxy-3-[(2-methyl(4-hydroimidazo[1,2 -a]pyridin-3-yl))carbonyl]-5-oxo-3-pyrrolin-2-yl}benzoate
| Molecular Formula | C28H32N4O5 |
|---|---|
| Molecular Weight | 504.24 g/mol |
| LogP | 3.58292 |
| Topological Polar Surface Area | 104.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 504.23727 |
| Heavy Atoms | 37 |
| Complexity | 1354.6545 |
Chemical Identifiers
| CAS Number | 630064-39-0 |
|---|---|
| SMILES | CCN(CC)CCCN1C(/C(=C(/C2=C(N=C3N2C=CC=C3)C)\O)/C(=O)C1=O)C4=CC=C(C=C4)C(=O)OC |
Product Overview
methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate (CAS 630064-39-0), with molecular formula C28H32N4O5 and molecular weight 504.24 g/mol. IUPAC: methyl 4-[(3E)-1-[3-(diethylamino)propyl]-3-[hydroxy-(2-methylimidazo[1,2-a]pyridin-3-yl)methylidene]-4,5-dioxopyrrolidin-2-yl]benzoate.
Chemical Property Profile of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
Property Insights of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
The XLogP value of 3.58292 indicates that methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.45 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate. Following Lipinski's Rule of Five, methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate?
The CAS number of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate is 630064-39-0.
What is the molecular formula of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate?
The molecular formula of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate is C28H32N4O5.
What is the molecular weight of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate?
The molecular weight of methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate is 504.24 g/mol.
Where can I buy methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate?
You can request a quote for methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(1-(3-(diethylamino)propyl)-4-hydroxy-3-(2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.