VU0489454-1
TL;DR: VU0489454-1 (CAS 326178-78-3) is a chemical compound with molecular formula C22H25N3O7S and molecular weight 475.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)piperidin-1-yl]sulfonylphenyl]carbamate
Also Known As: VU0489454-1, F1686-0105, AF-399/13949032, methyl N-[4-({3-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]piperidin-1-yl}sulfonyl)phenyl]carbamate, methyl (4-((3-((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)carbamoyl)piperidin-1-yl)sulfonyl)phenyl)carbamate
| Molecular Formula | C22H25N3O7S |
|---|---|
| Molecular Weight | 475.14 g/mol |
| LogP | 2.6755 |
| Topological Polar Surface Area | 123.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.14133 |
| Heavy Atoms | 33 |
| Complexity | 1135.1785 |
Chemical Identifiers
| CAS Number | 326178-78-3 |
|---|---|
| SMILES | COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC4=C(C=C3)OCCO4 |
Product Overview
VU0489454-1 (CAS 326178-78-3), with molecular formula C22H25N3O7S and molecular weight 475.14 g/mol. IUPAC: methyl N-[4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)piperidin-1-yl]sulfonylphenyl]carbamate.
Chemical Property Profile of VU0489454-1
Property Insights of VU0489454-1
The XLogP value of 2.6755 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0489454-1. The TPSA of 123.27 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0489454-1. Following Lipinski's Rule of Five, VU0489454-1 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 VU0489454-1?
The CAS number of VU0489454-1 is 326178-78-3.
What is the molecular formula of VU0489454-1?
The molecular formula of VU0489454-1 is C22H25N3O7S.
What is the molecular weight of VU0489454-1?
The molecular weight of VU0489454-1 is 475.14 g/mol.
Where can I buy VU0489454-1?
You can request a quote for VU0489454-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0489454-1?
Yes, KEHONG BIO provides custom synthesis services for VU0489454-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.