Pivampicillin pamoate
TL;DR: Pivampicillin pamoate (CAS 39030-72-3) is a chemical compound with molecular formula C45H45N3O12S and molecular weight 851.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Also Known As: Pivampicillin pamoate, Pivampicillin pamoate (USAN), 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid; 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
| Molecular Formula | C45H45N3O12S |
|---|---|
| Molecular Weight | 851.27 g/mol |
| LogP | 5.7149 |
| Topological Polar Surface Area | 243.09 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 851.2724 |
| Heavy Atoms | 61 |
| Complexity | 2470.464 |
Chemical Identifiers
| CAS Number | 39030-72-3 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)OCOC(=O)C(C)(C)C)C.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O |
Product Overview
Pivampicillin pamoate (CAS 39030-72-3), with molecular formula C45H45N3O12S and molecular weight 851.27 g/mol. IUPAC: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate.
Chemical Property Profile of Pivampicillin pamoate
Property Insights of Pivampicillin pamoate
The XLogP value of 5.7149 indicates that Pivampicillin pamoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 243.09 Ų indicates high polarity, suggesting Pivampicillin pamoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pivampicillin pamoate has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pivampicillin pamoate?
The CAS number of Pivampicillin pamoate is 39030-72-3.
What is the molecular formula of Pivampicillin pamoate?
The molecular formula of Pivampicillin pamoate is C45H45N3O12S.
What is the molecular weight of Pivampicillin pamoate?
The molecular weight of Pivampicillin pamoate is 851.27 g/mol.
Where can I buy Pivampicillin pamoate?
You can request a quote for Pivampicillin pamoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pivampicillin pamoate?
Yes, KEHONG BIO provides custom synthesis services for Pivampicillin pamoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.