Pent-3-enanilide
TL;DR: Pent-3-enanilide (CAS 13555-65-2) is a chemical compound with molecular formula C11H13NO and molecular weight 175.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenylpent-3-enamide
Also Known As: pent-3-enanilide, pent-2-enoic acid anilide
| Molecular Formula | C11H13NO |
|---|---|
| Molecular Weight | 175.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.09972 |
| Heavy Atoms | 13 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 13555-65-2 |
|---|---|
| SMILES | CC=CCC(=O)NC1=CC=CC=C1 |
| InChIKey | CQHHCIXYMKHOJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pent-3-enanilide (CAS 13555-65-2), with molecular formula C11H13NO and molecular weight 175.10 g/mol. IUPAC: N-phenylpent-3-enamide.
Chemical Property Profile of Pent-3-enanilide
Property Insights of Pent-3-enanilide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pent-3-enanilide. With a topological polar surface area (TPSA) of 29.1 Ų, Pent-3-enanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pent-3-enanilide has 1 hydrogen bond donor(s) and 1 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 Pent-3-enanilide?
The CAS number of Pent-3-enanilide is 13555-65-2.
What is the molecular formula of Pent-3-enanilide?
The molecular formula of Pent-3-enanilide is C11H13NO.
What is the molecular weight of Pent-3-enanilide?
The molecular weight of Pent-3-enanilide is 175.10 g/mol.
Where can I buy Pent-3-enanilide?
You can request a quote for Pent-3-enanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pent-3-enanilide?
Yes, KEHONG BIO provides custom synthesis services for Pent-3-enanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.