4-Phenylamino-3-penten-2-one
TL;DR: 4-Phenylamino-3-penten-2-one (CAS 7294-89-5) 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.
(Z)-4-anilinopent-3-en-2-one
Also Known As: 4-Phenylamino-3-penten-2-one, (z)-4-(phenylamino)pent-3-en-2-one, (Z)-4-anilinopent-3-en-2-one, 4-PHENYLAMINOPENT-3-EN-2-ONE, 4-(Phenylamino)pent-3-en-2-one
| Molecular Formula | C11H13NO |
|---|---|
| Molecular Weight | 175.10 g/mol |
| LogP | 2.5913 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.09972 |
| Heavy Atoms | 13 |
| Complexity | 314.12198 |
Chemical Identifiers
| CAS Number | 7294-89-5 |
|---|---|
| SMILES | C/C(=C/C(=O)C)/NC1=CC=CC=C1 |
Product Overview
4-Phenylamino-3-penten-2-one (CAS 7294-89-5), with molecular formula C11H13NO and molecular weight 175.10 g/mol. IUPAC: (Z)-4-anilinopent-3-en-2-one.
Chemical Property Profile of 4-Phenylamino-3-penten-2-one
Property Insights of 4-Phenylamino-3-penten-2-one
The XLogP value of 2.5913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenylamino-3-penten-2-one. With a topological polar surface area (TPSA) of 29.1 Ų, 4-Phenylamino-3-penten-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylamino-3-penten-2-one 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-Phenylamino-3-penten-2-one?
The CAS number of 4-Phenylamino-3-penten-2-one is 7294-89-5.
What is the molecular formula of 4-Phenylamino-3-penten-2-one?
The molecular formula of 4-Phenylamino-3-penten-2-one is C11H13NO.
What is the molecular weight of 4-Phenylamino-3-penten-2-one?
The molecular weight of 4-Phenylamino-3-penten-2-one is 175.10 g/mol.
Where can I buy 4-Phenylamino-3-penten-2-one?
You can request a quote for 4-Phenylamino-3-penten-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Phenylamino-3-penten-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenylamino-3-penten-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.