VU0605609-1
TL;DR: VU0605609-1 (CAS 845652-97-3) is a chemical compound with molecular formula C23H26FN3O5 and molecular weight 443.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[1-[2-(dimethylamino)ethyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Also Known As: VU0605609-1, F3226-1776, methyl 4-(1-(2-(dimethylamino)ethyl)-2-(2-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate, methyl 4-{1-[2-(dimethylamino)ethyl]-2-(2-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrole-3-carbonyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate, methyl 4-({1-[2-(dimethylamino)ethyl]-2-(2-fluorophenyl)-4-hydroxy-5-oxo(3-pyr rolin-3-yl)}carbonyl)-3,5-dimethylpyrrole-2-carboxylate
| Molecular Formula | C23H26FN3O5 |
|---|---|
| Molecular Weight | 443.19 g/mol |
| LogP | 2.54054 |
| Topological Polar Surface Area | 102.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 443.18564 |
| Heavy Atoms | 32 |
| Complexity | 1118.8303 |
Chemical Identifiers
| CAS Number | 845652-97-3 |
|---|---|
| SMILES | CC1=C(NC(=C1/C(=C\2/C(N(C(=O)C2=O)CCN(C)C)C3=CC=CC=C3F)/O)C)C(=O)OC |
Product Overview
VU0605609-1 (CAS 845652-97-3), with molecular formula C23H26FN3O5 and molecular weight 443.19 g/mol. IUPAC: methyl 4-[(E)-[1-[2-(dimethylamino)ethyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene]-hydroxymethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate.
Chemical Property Profile of VU0605609-1
Property Insights of VU0605609-1
The XLogP value of 2.54054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0605609-1. The TPSA of 102.94 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605609-1. Following Lipinski's Rule of Five, VU0605609-1 has 2 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 VU0605609-1?
The CAS number of VU0605609-1 is 845652-97-3.
What is the molecular formula of VU0605609-1?
The molecular formula of VU0605609-1 is C23H26FN3O5.
What is the molecular weight of VU0605609-1?
The molecular weight of VU0605609-1 is 443.19 g/mol.
Where can I buy VU0605609-1?
You can request a quote for VU0605609-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605609-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605609-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.