VU0113348-2
TL;DR: VU0113348-2 (CAS 688053-80-7) is a chemical compound with molecular formula C23H23N3O6S and molecular weight 469.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)hexanamide
Also Known As: VU0113348-2, F3168-1966, N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}hexanamide, N-(1,3-benzodioxol-5-ylmethyl)-6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)hexanamide, N-(1,3-benzodioxol-5-ylmethyl)-6-(8-oxo-6-thioxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)hexanamide
| Molecular Formula | C23H23N3O6S |
|---|---|
| Molecular Weight | 469.13 g/mol |
| LogP | 3.39329 |
| Topological Polar Surface Area | 103.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.13077 |
| Heavy Atoms | 33 |
| Complexity | 1332.2468 |
Chemical Identifiers
| CAS Number | 688053-80-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)CCCCCN3C(=O)C4=CC5=C(C=C4NC3=S)OCO5 |
Product Overview
VU0113348-2 (CAS 688053-80-7), with molecular formula C23H23N3O6S and molecular weight 469.13 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)hexanamide.
Chemical Property Profile of VU0113348-2
Property Insights of VU0113348-2
The XLogP value of 3.39329 indicates that VU0113348-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.81 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0113348-2. Following Lipinski's Rule of Five, VU0113348-2 has 2 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 VU0113348-2?
The CAS number of VU0113348-2 is 688053-80-7.
What is the molecular formula of VU0113348-2?
The molecular formula of VU0113348-2 is C23H23N3O6S.
What is the molecular weight of VU0113348-2?
The molecular weight of VU0113348-2 is 469.13 g/mol.
Where can I buy VU0113348-2?
You can request a quote for VU0113348-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0113348-2?
Yes, KEHONG BIO provides custom synthesis services for VU0113348-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.