piperacillin
TL;DR: piperacillin (CAS 28932-22-1) is a chemical compound with molecular formula C44H80N2O15 and molecular weight 876.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-[(2R,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-7-[(2S,4R,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
Also Known As: piperacillin, Megalomicin, Piperacillina, Megalomicin A, Megalomycin-A
| Molecular Formula | C44H80N2O15 |
|---|---|
| Molecular Weight | 876.56 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 227.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 9 |
| Exact Mass | 876.55585 |
| Heavy Atoms | 61 |
| Complexity | 1460.0 |
Chemical Identifiers
| CAS Number | 28932-22-1 |
|---|---|
| SMILES | CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)O)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O[C@H]4C[C@H](C([C@@H](O4)C)O)N(C)C)C)C)O)(C)O |
| InChIKey | LRWRQTMTYVZKQW-KXDJUOJUSA-N |
Product Overview
piperacillin (CAS 28932-22-1), with molecular formula C44H80N2O15 and molecular weight 876.56 g/mol. IUPAC: (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-[(2R,4R,5S,6S)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-7-[(2S,4R,6S)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione.
Chemical Property Profile of piperacillin
Property Insights of piperacillin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for piperacillin. The TPSA of 227.0 Ų indicates high polarity, suggesting piperacillin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, piperacillin has 6 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of piperacillin?
The CAS number of piperacillin is 28932-22-1.
What is the molecular formula of piperacillin?
The molecular formula of piperacillin is C44H80N2O15.
What is the molecular weight of piperacillin?
The molecular weight of piperacillin is 876.56 g/mol.
Where can I buy piperacillin?
You can request a quote for piperacillin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for piperacillin?
Yes, KEHONG BIO provides custom synthesis services for piperacillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.