GR 69153
TL;DR: GR 69153 (CAS 130853-14-4) is a chemical compound with molecular formula C20H17N5O9S2 and molecular weight 535.04675 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-[(R)-carboxy-(3,4-dihydroxyphenyl)methoxy]iminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: GR 69153, (6R,7R)-7-[[(2E)-2-(2-Amino-1,3-thiazol-4-yl)-2-[(R)-carboxy-(3,4-dihydroxyphenyl)methoxy]iminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)((carboxy(3,4-dihydroxyphenyl)methoxy)imino)acetyl)amino)-8-oxo-, (6R-(6alpha,7beta(Z(R*))))-
Technical Specifications
| Molecular Formula | C20H17N5O9S2 |
| Molecular Weight | 535.04675 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 279.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.04675 Da |
| Heavy Atoms | 36 |
| Complexity | 995.0 |
| SMILES | C1C=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)/C(=N/O[C@H](C3=CC(=C(C=C3)O)O)C(=O)O)/C4=CSC(=N4)N)C(=O)O |
| InChIKey | ILZCDOYRDFDUPN-OFOHYGNPSA-N |
Chemical Property Profile of GR 69153
Property Insights of GR 69153
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for GR 69153. The TPSA of 279.0 Ų indicates high polarity, suggesting GR 69153 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GR 69153 has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of GR 69153?
The CAS number of GR 69153 is 130853-14-4.
What is the molecular formula of GR 69153?
The molecular formula of GR 69153 is C20H17N5O9S2.
What is the molecular weight of GR 69153?
The molecular weight of GR 69153 is 535.04675 g/mol.
Where can I buy GR 69153?
You can request a quote for GR 69153 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for GR 69153?
Yes, CoreyChem provides custom synthesis services for GR 69153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.