TL;DR: C18H23N2O6- (CAS 138775-03-8) is a chemical compound with molecular formula C18H23N2O6- and molecular weight 363.1556 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylmethoxycarbonylpiperazine-2-carboxylate
Also Known As: C18H23N2O6-, 1,2,4-PIPERAZINETRICARBOXYLIC ACID, 1-(1,1-DIMETHYLETHYL) 4-(PHENYLMETHYL) ESTER, (2S)-, (2S)-4-benzyloxycarbonyl-1-tert-butoxycarbonyl-piperazine-2-carboxylate
| Molecular Formula | C18H23N2O6- |
| Molecular Weight | 363.1556 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 99.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.1556 Da |
| Heavy Atoms | 26 |
| Complexity | 519.0 |
| SMILES | CC(C)(C)OC(=O)N1CCN(C[C@H]1C(=O)[O-])C(=O)OCC2=CC=CC=C2 |
| InChIKey | SREPAMKILVVDSP-AWEZNQCLSA-M |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C18H23N2O6-. The TPSA of 99.2 Ų falls within the moderate polarity range, balancing permeability and solubility for C18H23N2O6-. Following Lipinski's Rule of Five, C18H23N2O6- has 0 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 C18H23N2O6- is 138775-03-8.
The molecular formula of C18H23N2O6- is C18H23N2O6-.
The molecular weight of C18H23N2O6- is 363.1556 g/mol.
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