VU0618437-1
TL;DR: VU0618437-1 (CAS 727689-68-1) is a chemical compound with molecular formula C19H15N3O5S2 and molecular weight 429.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide
Also Known As: VU0618437-1, F3394-1243, N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[4-(3-nitrophenyl)-1,3-thiazol-2-yl]sulfanyl}acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-2-((4-(3-nitrophenyl)thiazol-2-yl)thio)acetamide
| Molecular Formula | C19H15N3O5S2 |
|---|---|
| Molecular Weight | 429.05 g/mol |
| LogP | 3.8555 |
| Topological Polar Surface Area | 103.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.04532 |
| Heavy Atoms | 29 |
| Complexity | 1069.503 |
Chemical Identifiers
| CAS Number | 727689-68-1 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
VU0618437-1 (CAS 727689-68-1), with molecular formula C19H15N3O5S2 and molecular weight 429.05 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide.
Chemical Property Profile of VU0618437-1
Property Insights of VU0618437-1
The XLogP value of 3.8555 indicates that VU0618437-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.59 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0618437-1. Following Lipinski's Rule of Five, VU0618437-1 has 1 hydrogen bond donor(s) and 8 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 VU0618437-1?
The CAS number of VU0618437-1 is 727689-68-1.
What is the molecular formula of VU0618437-1?
The molecular formula of VU0618437-1 is C19H15N3O5S2.
What is the molecular weight of VU0618437-1?
The molecular weight of VU0618437-1 is 429.05 g/mol.
Where can I buy VU0618437-1?
You can request a quote for VU0618437-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0618437-1?
Yes, KEHONG BIO provides custom synthesis services for VU0618437-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.