TL;DR: VU0496998-1 (CAS 1105215-40-4) is a chemical compound with molecular formula C17H19N3O4S2 and molecular weight 393.0817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-methylphenyl]-N-(thiophen-2-ylmethyl)oxamide
Also Known As: VU0496998-1, F2761-0276, N'-[5-(1,1-dioxo-1lambda6,2-thiazolidin-2-yl)-2-methylphenyl]-N-[(thiophen-2-yl)methyl]ethanediamide, N'-[5-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-methylphenyl]-N-(thiophen-2-ylmethyl)oxamide, N1-(5-(1,1-dioxidoisothiazolidin-2-yl)-2-methylphenyl)-N2-(thiophen-2-ylmethyl)oxalamide
| Molecular Formula | C17H19N3O4S2 |
| Molecular Weight | 393.0817 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.0817 Da |
| Heavy Atoms | 26 |
| Complexity | 634.0 |
| SMILES | CC1=C(C=C(C=C1)N2CCCS2(=O)=O)NC(=O)C(=O)NCC3=CC=CS3 |
| InChIKey | RXICHBCJIVSIDV-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0496998-1. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0496998-1. Following Lipinski's Rule of Five, VU0496998-1 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of VU0496998-1 is 1105215-40-4.
The molecular formula of VU0496998-1 is C17H19N3O4S2.
The molecular weight of VU0496998-1 is 393.0817 g/mol.
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