Clometocillin
TL;DR: Clometocillin (CAS 1926-49-4) is a chemical compound with molecular formula C17H18Cl2N2O5S and molecular weight 432.03134 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,5R,6R)-6-[[2-(3,4-dichlorophenyl)-2-methoxyacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Clometocillin, Clometacillin, Clometocilina, Clometocilline, clomethacillin
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H18Cl2N2O5S |
| Molecular Weight | 432.03134 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.03134 Da |
| Heavy Atoms | 27 |
| Complexity | 649.0 |
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC(=C(C=C3)Cl)Cl)OC)C(=O)O)C |
| InChIKey | JKXQBIZCQJLVOS-GSNLGQFWSA-N |
Chemical Property Profile of Clometocillin
Property Insights of Clometocillin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Clometocillin. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Clometocillin. Following Lipinski's Rule of Five, Clometocillin has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Clometocillin?
The CAS number of Clometocillin is 1926-49-4.
What is the molecular formula of Clometocillin?
The molecular formula of Clometocillin is C17H18Cl2N2O5S.
What is the molecular weight of Clometocillin?
The molecular weight of Clometocillin is 432.03134 g/mol.
Where can I buy Clometocillin?
You can request a quote for Clometocillin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Clometocillin?
Yes, CoreyChem provides custom synthesis services for Clometocillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.