4-Bromo-3-oxo-n-phenylbutanamide
TL;DR: 4-Bromo-3-oxo-n-phenylbutanamide (CAS 1208-65-7) is a chemical compound with molecular formula C10H10BrNO2 and molecular weight 254.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-3-oxo-N-phenylbutanamide
Also Known As: 4-bromo-3-oxo-n-phenylbutanamide, Antafenite, 4-bromoacetoacetanilide, gamma-bromoacetoacetanilide, Acetoacetanilide, 4-bromo-
| Molecular Formula | C10H10BrNO2 |
|---|---|
| Molecular Weight | 254.99 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.98949 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 1208-65-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)CC(=O)CBr |
| InChIKey | RJTROOIXLNVHNB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromo-3-oxo-n-phenylbutanamide (CAS 1208-65-7), with molecular formula C10H10BrNO2 and molecular weight 254.99 g/mol. IUPAC: 4-bromo-3-oxo-N-phenylbutanamide.
Chemical Property Profile of 4-Bromo-3-oxo-n-phenylbutanamide
Property Insights of 4-Bromo-3-oxo-n-phenylbutanamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-3-oxo-n-phenylbutanamide. With a topological polar surface area (TPSA) of 46.2 Ų, 4-Bromo-3-oxo-n-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-3-oxo-n-phenylbutanamide 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-Bromo-3-oxo-n-phenylbutanamide?
The CAS number of 4-Bromo-3-oxo-n-phenylbutanamide is 1208-65-7.
What is the molecular formula of 4-Bromo-3-oxo-n-phenylbutanamide?
The molecular formula of 4-Bromo-3-oxo-n-phenylbutanamide is C10H10BrNO2.
What is the molecular weight of 4-Bromo-3-oxo-n-phenylbutanamide?
The molecular weight of 4-Bromo-3-oxo-n-phenylbutanamide is 254.99 g/mol.
Where can I buy 4-Bromo-3-oxo-n-phenylbutanamide?
You can request a quote for 4-Bromo-3-oxo-n-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-3-oxo-n-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-3-oxo-n-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.