Ticarcillinum
TL;DR: Ticarcillinum (CAS 94493-53-5) is a chemical compound with molecular formula C15H16N2O6S2 and molecular weight 384.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6R)-6-[[(2S)-2-carboxy-2-thiophen-3-ylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Ticarcillinum, Ticarcilina, Ticarcilline, (S)-Ticarcillin, TICARCILLIN
| Molecular Formula | C15H16N2O6S2 |
|---|---|
| Molecular Weight | 384.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 178.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.04498 |
| Heavy Atoms | 25 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 94493-53-5 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@H](C3=CSC=C3)C(=O)O)C(=O)O)C |
| InChIKey | OHKOGUYZJXTSFX-KIKITERTSA-N |
Product Overview
Ticarcillinum (CAS 94493-53-5), with molecular formula C15H16N2O6S2 and molecular weight 384.04 g/mol. IUPAC: (2S,5R,6R)-6-[[(2S)-2-carboxy-2-thiophen-3-ylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of Ticarcillinum
Property Insights of Ticarcillinum
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ticarcillinum. The TPSA of 178.0 Ų indicates high polarity, suggesting Ticarcillinum may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ticarcillinum has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ticarcillinum?
The CAS number of Ticarcillinum is 94493-53-5.
What is the molecular formula of Ticarcillinum?
The molecular formula of Ticarcillinum is C15H16N2O6S2.
What is the molecular weight of Ticarcillinum?
The molecular weight of Ticarcillinum is 384.04 g/mol.
Where can I buy Ticarcillinum?
You can request a quote for Ticarcillinum directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ticarcillinum?
Yes, KEHONG BIO provides custom synthesis services for Ticarcillinum and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.