N-Allyl-4-bromobenzamide
TL;DR: N-Allyl-4-bromobenzamide (CAS 39887-27-9) is a chemical compound with molecular formula C10H10BrNO and molecular weight 238.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-prop-2-enylbenzamide
Also Known As: N-ALLYL-4-BROMOBENZAMIDE, N-Allyl-4-brombenzamid, 4-bromo-N-prop-2-enylbenzamide, N-allyl-4-bromo-benzamide, Benzamide, 4-bromo-N-allyl-
| Molecular Formula | C10H10BrNO |
|---|---|
| Molecular Weight | 238.99 g/mol |
| LogP | 2.3649 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.99458 |
| Heavy Atoms | 13 |
| Complexity | 305.20572 |
Chemical Identifiers
| CAS Number | 39887-27-9 |
|---|---|
| SMILES | C=CCNC(=O)C1=CC=C(C=C1)Br |
Product Overview
N-Allyl-4-bromobenzamide (CAS 39887-27-9), with molecular formula C10H10BrNO and molecular weight 238.99 g/mol. IUPAC: 4-bromo-N-prop-2-enylbenzamide.
Chemical Property Profile of N-Allyl-4-bromobenzamide
Property Insights of N-Allyl-4-bromobenzamide
The XLogP value of 2.3649 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Allyl-4-bromobenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-Allyl-4-bromobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Allyl-4-bromobenzamide 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 N-Allyl-4-bromobenzamide?
The CAS number of N-Allyl-4-bromobenzamide is 39887-27-9.
What is the molecular formula of N-Allyl-4-bromobenzamide?
The molecular formula of N-Allyl-4-bromobenzamide is C10H10BrNO.
What is the molecular weight of N-Allyl-4-bromobenzamide?
The molecular weight of N-Allyl-4-bromobenzamide is 238.99 g/mol.
Where can I buy N-Allyl-4-bromobenzamide?
You can request a quote for N-Allyl-4-bromobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Allyl-4-bromobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-Allyl-4-bromobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.