VU0605414-1
TL;DR: VU0605414-1 (CAS 636991-45-2) is a chemical compound with molecular formula C23H28N2O5S and molecular weight 444.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propyl]-2-(4-ethoxy-3-methoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: VU0605414-1, 1-(3-(dimethylamino)propyl)-5-(4-ethoxy-3-methoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one, AO-022/42398641, F3226-0368, 1-[3-(dimethylamino)propyl]-5-(4-ethoxy-3-methoxyphenyl)-3-hydroxy-4-(thiophene-2-carbonyl)-2,5-dihydro-1H-pyrrol-2-one
| Molecular Formula | C23H28N2O5S |
|---|---|
| Molecular Weight | 444.17 g/mol |
| LogP | 3.6854 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 444.1719 |
| Heavy Atoms | 31 |
| Complexity | 968.3514 |
Chemical Identifiers
| CAS Number | 636991-45-2 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2CCCN(C)C)O)C(=O)C3=CC=CS3)OC |
Product Overview
VU0605414-1 (CAS 636991-45-2), with molecular formula C23H28N2O5S and molecular weight 444.17 g/mol. IUPAC: 1-[3-(dimethylamino)propyl]-2-(4-ethoxy-3-methoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of VU0605414-1
Property Insights of VU0605414-1
The XLogP value of 3.6854 indicates that VU0605414-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.31 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605414-1. Following Lipinski's Rule of Five, VU0605414-1 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 VU0605414-1?
The CAS number of VU0605414-1 is 636991-45-2.
What is the molecular formula of VU0605414-1?
The molecular formula of VU0605414-1 is C23H28N2O5S.
What is the molecular weight of VU0605414-1?
The molecular weight of VU0605414-1 is 444.17 g/mol.
Where can I buy VU0605414-1?
You can request a quote for VU0605414-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605414-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605414-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.