PICIBANIL
TL;DR: PICIBANIL (CAS 39325-01-4) is a chemical compound with molecular formula C16H17N2O4S- and molecular weight 333.0909 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Also Known As: PICIBANIL, BAS 00792992, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, 3,3-DIMETHYL-7-OXO-6-(2-PHENYLACETAMIDO)-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLATE, 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Technical Specifications
| Molecular Formula | C16H17N2O4S- |
| Molecular Weight | 333.0909 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.0909 Da |
| Heavy Atoms | 23 |
| Complexity | 525.0 |
| SMILES | CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-])C |
| InChIKey | JGSARLDLIJGVTE-UHFFFAOYSA-M |
Product Description
Applications: PICIBANIL is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, PICIBANIL (CAS 39325-01-4) has the molecular formula C16H17N2O4S- and a molecular weight of 333.09 g/mol. Synonyms include PICIBANIL and BAS 00792992.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of PICIBANIL
Property Insights of PICIBANIL
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PICIBANIL. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for PICIBANIL. Following Lipinski's Rule of Five, PICIBANIL has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of PICIBANIL?
The CAS number of PICIBANIL is 39325-01-4.
What is the molecular formula of PICIBANIL?
The molecular formula of PICIBANIL is C16H17N2O4S-.
What is the molecular weight of PICIBANIL?
The molecular weight of PICIBANIL is 333.0909 g/mol.
What are the applications of PICIBANIL?
PICIBANIL is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy PICIBANIL?
You can request a quote for PICIBANIL directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PICIBANIL?
Yes, CoreyChem provides custom synthesis services for PICIBANIL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.