VU0605513-1
TL;DR: VU0605513-1 (CAS 618422-86-9) is a chemical compound with molecular formula C22H16N2O4S2 and molecular weight 436.06 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)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: VU0605513-1, 1-(6-ethylbenzo[d]thiazol-2-yl)-5-(furan-2-yl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one, F3226-1095, 1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(furan-2-yl)-3-hydroxy-4-(thiophene-2-carbonyl)-2,5-dihydro-1H-pyrrol-2-one, 1-(6-ethyl-1,3-benzothiazol-2-yl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
| Molecular Formula | C22H16N2O4S2 |
|---|---|
| Molecular Weight | 436.06 g/mol |
| LogP | 5.2961 |
| Topological Polar Surface Area | 83.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 436.05515 |
| Heavy Atoms | 30 |
| Complexity | 1286.1589 |
Chemical Identifiers
| CAS Number | 618422-86-9 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC=CO5 |
Product Overview
VU0605513-1 (CAS 618422-86-9), with molecular formula C22H16N2O4S2 and molecular weight 436.06 g/mol. IUPAC: 1-(6-ethyl-1,3-benzothiazol-2-yl)-2-(furan-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of VU0605513-1
Property Insights of VU0605513-1
The XLogP value of 5.2961 indicates that VU0605513-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.64 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0605513-1. Following Lipinski's Rule of Five, VU0605513-1 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 VU0605513-1?
The CAS number of VU0605513-1 is 618422-86-9.
What is the molecular formula of VU0605513-1?
The molecular formula of VU0605513-1 is C22H16N2O4S2.
What is the molecular weight of VU0605513-1?
The molecular weight of VU0605513-1 is 436.06 g/mol.
Where can I buy VU0605513-1?
You can request a quote for VU0605513-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0605513-1?
Yes, KEHONG BIO provides custom synthesis services for VU0605513-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.