VU0113310-2
TL;DR: VU0113310-2 (CAS 422283-71-4) is a chemical compound with molecular formula C25H27N3O4S and molecular weight 465.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[4-(cycloheptylcarbamoyl)phenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate
Also Known As: VU0113310-2, F3168-1770, methyl 3-(4-(cycloheptylcarbamoyl)benzyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate, methyl 3-[[4-(cycloheptylcarbamoyl)phenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate, methyl 3-{[4-(cycloheptylcarbamoyl)phenyl]methyl}-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylate
| Molecular Formula | C25H27N3O4S |
|---|---|
| Molecular Weight | 465.17 g/mol |
| LogP | 4.34659 |
| Topological Polar Surface Area | 93.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 465.17224 |
| Heavy Atoms | 33 |
| Complexity | 1285.7352 |
Chemical Identifiers
| CAS Number | 422283-71-4 |
|---|---|
| SMILES | COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)C(=O)NC4CCCCCC4 |
Product Overview
VU0113310-2 (CAS 422283-71-4), with molecular formula C25H27N3O4S and molecular weight 465.17 g/mol. IUPAC: methyl 3-[[4-(cycloheptylcarbamoyl)phenyl]methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate.
Chemical Property Profile of VU0113310-2
Property Insights of VU0113310-2
The XLogP value of 4.34659 indicates that VU0113310-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.19 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0113310-2. Following Lipinski's Rule of Five, VU0113310-2 has 2 hydrogen bond donor(s) and 5 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 VU0113310-2?
The CAS number of VU0113310-2 is 422283-71-4.
What is the molecular formula of VU0113310-2?
The molecular formula of VU0113310-2 is C25H27N3O4S.
What is the molecular weight of VU0113310-2?
The molecular weight of VU0113310-2 is 465.17 g/mol.
Where can I buy VU0113310-2?
You can request a quote for VU0113310-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0113310-2?
Yes, KEHONG BIO provides custom synthesis services for VU0113310-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.