VU0227470-4
TL;DR: VU0227470-4 (CAS 688055-55-2) is a chemical compound with molecular formula C23H24N4O4S and molecular weight 452.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide
Also Known As: VU0227470-4, 4-[(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide, 4-[(8-oxo-6-thioxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide, 4-({8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}methyl)-N-[2-(pyrrolidin-1-yl)ethyl]benzamide, 4-((8-oxo-6-thioxo-5,6-dihydro-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)methyl)-N-(2-(pyrrolidin-1-yl)ethyl)benzamide
| Molecular Formula | C23H24N4O4S |
|---|---|
| Molecular Weight | 452.15 g/mol |
| LogP | 2.66169 |
| Topological Polar Surface Area | 88.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.15182 |
| Heavy Atoms | 32 |
| Complexity | 1276.1265 |
Chemical Identifiers
| CAS Number | 688055-55-2 |
|---|---|
| SMILES | C1CCN(C1)CCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC5=C(C=C4NC3=S)OCO5 |
Product Overview
VU0227470-4 (CAS 688055-55-2), with molecular formula C23H24N4O4S and molecular weight 452.15 g/mol. IUPAC: 4-[(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)methyl]-N-(2-pyrrolidin-1-ylethyl)benzamide.
Chemical Property Profile of VU0227470-4
Property Insights of VU0227470-4
The XLogP value of 2.66169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0227470-4. The TPSA of 88.59 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0227470-4. Following Lipinski's Rule of Five, VU0227470-4 has 2 hydrogen bond donor(s) and 6 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 VU0227470-4?
The CAS number of VU0227470-4 is 688055-55-2.
What is the molecular formula of VU0227470-4?
The molecular formula of VU0227470-4 is C23H24N4O4S.
What is the molecular weight of VU0227470-4?
The molecular weight of VU0227470-4 is 452.15 g/mol.
Where can I buy VU0227470-4?
You can request a quote for VU0227470-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0227470-4?
Yes, KEHONG BIO provides custom synthesis services for VU0227470-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.