N-(4-oxopent-2-en-2-yl)benzamide
TL;DR: N-(4-oxopent-2-en-2-yl)benzamide (CAS 1137-98-0) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-oxopent-2-en-2-yl)benzamide
Also Known As: N-(4-oxopent-2-en-2-yl)benzamide, Benzamide, N-(4-oxo-2-penten-2-yl)-, (Z)-
| Molecular Formula | C12H13NO2 |
|---|---|
| Molecular Weight | 203.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.09464 |
| Heavy Atoms | 15 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 1137-98-0 |
|---|---|
| SMILES | CC(=CC(=O)C)NC(=O)C1=CC=CC=C1 |
| InChIKey | QCFXCRRHGBLGEN-UHFFFAOYSA-N |
Product Overview
N-(4-oxopent-2-en-2-yl)benzamide (CAS 1137-98-0), with molecular formula C12H13NO2 and molecular weight 203.09 g/mol. IUPAC: N-(4-oxopent-2-en-2-yl)benzamide.
Chemical Property Profile of N-(4-oxopent-2-en-2-yl)benzamide
Property Insights of N-(4-oxopent-2-en-2-yl)benzamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-oxopent-2-en-2-yl)benzamide. With a topological polar surface area (TPSA) of 46.2 Ų, N-(4-oxopent-2-en-2-yl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-oxopent-2-en-2-yl)benzamide 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 N-(4-oxopent-2-en-2-yl)benzamide?
The CAS number of N-(4-oxopent-2-en-2-yl)benzamide is 1137-98-0.
What is the molecular formula of N-(4-oxopent-2-en-2-yl)benzamide?
The molecular formula of N-(4-oxopent-2-en-2-yl)benzamide is C12H13NO2.
What is the molecular weight of N-(4-oxopent-2-en-2-yl)benzamide?
The molecular weight of N-(4-oxopent-2-en-2-yl)benzamide is 203.09 g/mol.
Where can I buy N-(4-oxopent-2-en-2-yl)benzamide?
You can request a quote for N-(4-oxopent-2-en-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-oxopent-2-en-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-oxopent-2-en-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.