TL;DR: Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester (CAS 105172-43-8) is a chemical compound with molecular formula C13H22N2O6 and molecular weight 302.1478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-[butan-2-yl(carboxymethyl)amino]-5-oxopentanoyl]amino]acetic acid
Also Known As: N,N'-(1,5-Dioxo-1,5-pentanediyl)bisglycine diethyl ester, Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester, 2-[[5-[butan-2-yl(carboxymethyl)amino]-5-oxopentanoyl]amino]acetic acid, BRN 5824313
| Molecular Formula | C13H22N2O6 |
| Molecular Weight | 302.1478 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 302.1478 Da |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
| SMILES | CCC(C)N(CC(=O)O)C(=O)CCCC(=O)NCC(=O)O |
| InChIKey | SNOWTASDPTZTQY-UHFFFAOYSA-N |
The XLogP value of -0.2 indicates that Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester. Following Lipinski's Rule of Five, Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester has 3 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 Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester is 105172-43-8.
The molecular formula of Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester is C13H22N2O6.
The molecular weight of Glycine, N,N'-(1,5-dioxo-1,5-pentanediyl)bis-, diethyl ester is 302.1478 g/mol.
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