4-Piperidinone, 3-(phenylmethylene)-
TL;DR: 4-Piperidinone, 3-(phenylmethylene)- (CAS 775227-33-3) is a chemical compound with molecular formula C12H13NO and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylidenepiperidin-4-one
Also Known As: 3-benzylidenepiperidin-4-one, 4-Piperidinone, 3-(phenylmethylene)-, NCI60_014395, RefChem:295921
| Molecular Formula | C12H13NO |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.09972 |
| Heavy Atoms | 14 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 775227-33-3 |
|---|---|
| SMILES | C1CNCC(=CC2=CC=CC=C2)C1=O |
| InChIKey | YLZHKYLBIUOBOE-UHFFFAOYSA-N |
Product Overview
4-Piperidinone, 3-(phenylmethylene)- (CAS 775227-33-3), with molecular formula C12H13NO and molecular weight 187.10 g/mol. IUPAC: 3-benzylidenepiperidin-4-one.
Chemical Property Profile of 4-Piperidinone, 3-(phenylmethylene)-
Property Insights of 4-Piperidinone, 3-(phenylmethylene)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Piperidinone, 3-(phenylmethylene)-. With a topological polar surface area (TPSA) of 29.1 Ų, 4-Piperidinone, 3-(phenylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Piperidinone, 3-(phenylmethylene)- has 1 hydrogen bond donor(s) and 2 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 4-Piperidinone, 3-(phenylmethylene)-?
The CAS number of 4-Piperidinone, 3-(phenylmethylene)- is 775227-33-3.
What is the molecular formula of 4-Piperidinone, 3-(phenylmethylene)-?
The molecular formula of 4-Piperidinone, 3-(phenylmethylene)- is C12H13NO.
What is the molecular weight of 4-Piperidinone, 3-(phenylmethylene)-?
The molecular weight of 4-Piperidinone, 3-(phenylmethylene)- is 187.10 g/mol.
Where can I buy 4-Piperidinone, 3-(phenylmethylene)-?
You can request a quote for 4-Piperidinone, 3-(phenylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidinone, 3-(phenylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidinone, 3-(phenylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.