VU0041457-2
TL;DR: VU0041457-2 (CAS 488706-67-8) is a chemical compound with molecular formula C23H20N2O5S and molecular weight 436.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxochromen-7-yl] morpholine-4-carboxylate
Also Known As: VU0041457-2, 3-(benzo[d]thiazol-2-yl)-2,8-dimethyl-4-oxo-4H-chromen-7-yl morpholine-4-carboxylate, [3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxochromen-7-yl] morpholine-4-carboxylate, F3139-0335, (3-benzothiazol-2-yl-2,8-dimethyl-4-oxo-chromen-7-yl) Morpholine-4-carboxylate
| Molecular Formula | C23H20N2O5S |
|---|---|
| Molecular Weight | 436.11 g/mol |
| LogP | 4.51754 |
| Topological Polar Surface Area | 81.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 436.10928 |
| Heavy Atoms | 31 |
| Complexity | 1334.9078 |
Chemical Identifiers
| CAS Number | 488706-67-8 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=C(C2=O)C3=NC4=CC=CC=C4S3)C)OC(=O)N5CCOCC5 |
Product Overview
VU0041457-2 (CAS 488706-67-8), with molecular formula C23H20N2O5S and molecular weight 436.11 g/mol. IUPAC: [3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxochromen-7-yl] morpholine-4-carboxylate.
Chemical Property Profile of VU0041457-2
Property Insights of VU0041457-2
The XLogP value of 4.51754 indicates that VU0041457-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.87 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0041457-2. Following Lipinski's Rule of Five, VU0041457-2 has 0 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 VU0041457-2?
The CAS number of VU0041457-2 is 488706-67-8.
What is the molecular formula of VU0041457-2?
The molecular formula of VU0041457-2 is C23H20N2O5S.
What is the molecular weight of VU0041457-2?
The molecular weight of VU0041457-2 is 436.11 g/mol.
Where can I buy VU0041457-2?
You can request a quote for VU0041457-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0041457-2?
Yes, KEHONG BIO provides custom synthesis services for VU0041457-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.