thiophen-2-ylmethyl-penicillin
TL;DR: thiophen-2-ylmethyl-penicillin (CAS 13268-65-0) is a chemical compound with molecular formula C14H16N2O4S2 and molecular weight 340.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-thiophen-2-ylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: thiophen-2-ylmethyl-penicillin, (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-thiophen-2-ylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, (2S,5R,6R)-3,3-Dimethyl-7-oxo-6-[2-(thiophen-2-yl)acetamido]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylicacid, 3,3-dimethyl-7-oxo-6-[(2-thienylacetyl)amino]-, (2S,5R,6R)- (9CI)
| Molecular Formula | C14H16N2O4S2 |
|---|---|
| Molecular Weight | 340.06 g/mol |
| LogP | 0.9223 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.05515 |
| Heavy Atoms | 22 |
| Complexity | 628.7972 |
Chemical Identifiers
| CAS Number | 13268-65-0 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CS3)C(=O)O)C |
Product Overview
thiophen-2-ylmethyl-penicillin (CAS 13268-65-0), with molecular formula C14H16N2O4S2 and molecular weight 340.06 g/mol. IUPAC: (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-thiophen-2-ylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of thiophen-2-ylmethyl-penicillin
Property Insights of thiophen-2-ylmethyl-penicillin
The XLogP value of 0.9223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for thiophen-2-ylmethyl-penicillin. The TPSA of 86.71 Ų falls within the moderate polarity range, balancing permeability and solubility for thiophen-2-ylmethyl-penicillin. Following Lipinski's Rule of Five, thiophen-2-ylmethyl-penicillin has 2 hydrogen bond donor(s) and 5 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 thiophen-2-ylmethyl-penicillin?
The CAS number of thiophen-2-ylmethyl-penicillin is 13268-65-0.
What is the molecular formula of thiophen-2-ylmethyl-penicillin?
The molecular formula of thiophen-2-ylmethyl-penicillin is C14H16N2O4S2.
What is the molecular weight of thiophen-2-ylmethyl-penicillin?
The molecular weight of thiophen-2-ylmethyl-penicillin is 340.06 g/mol.
Where can I buy thiophen-2-ylmethyl-penicillin?
You can request a quote for thiophen-2-ylmethyl-penicillin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for thiophen-2-ylmethyl-penicillin?
Yes, KEHONG BIO provides custom synthesis services for thiophen-2-ylmethyl-penicillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.