TL;DR: Tazocin (CAS 157044-21-8) is a chemical compound with molecular formula C34H41N9O12S2 and molecular weight 831.2316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,5R,6R)-6-[[(2S)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylpropanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;(2S,3S,5R)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4λ6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Tazocin, Piperacillin & Tazobactam, Piperacillin-tazobactam combination product, Piperacillin sodium - tazobactam sodium, (2S,5R,6R)-6-[[(2S)-2-[(4-ethyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-phenyl-propanoyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid; (2S,3S,5R)-3-methyl-4,4,7-trioxo-3-(triazol-1-ylmethyl)-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
| Molecular Formula | C34H41N9O12S2 |
| Molecular Weight | 831.2316 g/mol |
| XLogP | -1.5894 |
| Topological Polar Surface Area (TPSA) | 313.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 9 |
| Exact Mass | 831.2316 Da |
| Heavy Atoms | 57 |
| Complexity | 1600.0 |
| SMILES | CCN1CCN(C(=O)C1=O)C(=O)N[C@@](C)(C2=CC=CC=C2)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O.C[C@@]1([C@@H](N2[C@H](S1(=O)=O)CC2=O)C(=O)O)CN3C=CN=N3 |
| InChIKey | OMHKGGVTRDBBEJ-WVPIKCCXSA-N |
The XLogP value of -1.5894 indicates that Tazocin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 313.0 Ų indicates high polarity, suggesting Tazocin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tazocin has 4 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tazocin is 157044-21-8.
The molecular formula of Tazocin is C34H41N9O12S2.
The molecular weight of Tazocin is 831.2316 g/mol.
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