7-Atpcc
TL;DR: 7-Atpcc (CAS 128236-34-0) is a chemical compound with molecular formula C22H22N6O9S2 and molecular weight 578.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-3-[(3-hydroxy-4-oxo-1-pyridinyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: 7-Atpcc, 7-(2-(2-Aminothiazole-4-yl)-2-(1-carboxy-1-methyl)ethoxyiminoacetamido)-3-(3-hydroxy-4-pyridon-1-yl)methyl-3-cephem-4-carboxylic acid, (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-3-[(3-hydroxy-4-oxopyridin-1-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-(2-(2-aminothiazole-4-yl)-2-(1-carboxy-1-methyl)ethoxyiminoacetamido)-3-(3-hydroxy-4-pyridon-1-yl), RefChem:105659
| Molecular Formula | C22H22N6O9S2 |
|---|---|
| Molecular Weight | 578.09 g/mol |
| LogP | -0.3847 |
| Topological Polar Surface Area | 226.74 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 578.089 |
| Heavy Atoms | 39 |
| Complexity | 1494.6375 |
Chemical Identifiers
| CAS Number | 128236-34-0 |
|---|---|
| SMILES | CC(C)(C(=O)O)O/N=C(\C1=CSC(=N1)N)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CN4C=CC(=O)C(=C4)O)C(=O)O |
Product Overview
7-Atpcc (CAS 128236-34-0), with molecular formula C22H22N6O9S2 and molecular weight 578.09 g/mol. IUPAC: (6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-3-[(3-hydroxy-4-oxo-1-pyridinyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of 7-Atpcc
Property Insights of 7-Atpcc
The XLogP value of -0.3847 indicates that 7-Atpcc is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 226.74 Ų indicates high polarity, suggesting 7-Atpcc may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 7-Atpcc has 5 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 7-Atpcc?
The CAS number of 7-Atpcc is 128236-34-0.
What is the molecular formula of 7-Atpcc?
The molecular formula of 7-Atpcc is C22H22N6O9S2.
What is the molecular weight of 7-Atpcc?
The molecular weight of 7-Atpcc is 578.09 g/mol.
Where can I buy 7-Atpcc?
You can request a quote for 7-Atpcc directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Atpcc?
Yes, KEHONG BIO provides custom synthesis services for 7-Atpcc and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.