VU0605462-1
TL;DR: VU0605462-1 (CAS 618414-87-2) is a chemical compound with molecular formula C22H16N2O5S and molecular weight 420.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-2-(furan-2-yl)-4-hydroxy-2H-pyrrol-5-one
Also Known As: VU0605462-1, 1-(6-ethylbenzo[d]thiazol-2-yl)-4-(furan-2-carbonyl)-5-(furan-2-yl)-3-hydroxy-1H-pyrrol-2(5H)-one, F3226-0716, 1-(6-ethyl-1,3-benzothiazol-2-yl)-4-(furan-2-carbonyl)-5-(furan-2-yl)-3-hydroxy-2,5-dihydro-1H-pyrrol-2-one, 1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-2-(furan-2-yl)-4-hydroxy-2H-pyrrol-5-one
| Molecular Formula | C22H16N2O5S |
|---|---|
| Molecular Weight | 420.08 g/mol |
| LogP | 4.8276 |
| Topological Polar Surface Area | 96.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.078 |
| Heavy Atoms | 30 |
| Complexity | 1284.5493 |
Chemical Identifiers
| CAS Number | 618414-87-2 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CO4)C5=CC=CO5 |
Product Overview
VU0605462-1 (CAS 618414-87-2), with molecular formula C22H16N2O5S and molecular weight 420.08 g/mol. IUPAC: 1-(6-ethyl-1,3-benzothiazol-2-yl)-3-(furan-2-carbonyl)-2-(furan-2-yl)-4-hydroxy-2H-pyrrol-5-one.
Chemical Property Profile of VU0605462-1
Property Insights of VU0605462-1
The XLogP value of 4.8276 indicates that VU0605462-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.78 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605462-1. Following Lipinski's Rule of Five, VU0605462-1 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 VU0605462-1?
The CAS number of VU0605462-1 is 618414-87-2.
What is the molecular formula of VU0605462-1?
The molecular formula of VU0605462-1 is C22H16N2O5S.
What is the molecular weight of VU0605462-1?
The molecular weight of VU0605462-1 is 420.08 g/mol.
Where can I buy VU0605462-1?
You can request a quote for VU0605462-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605462-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605462-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.