N-benzyl-4-bromo-N-isopropylbenzamide
TL;DR: N-benzyl-4-bromo-N-isopropylbenzamide (CAS 349396-01-6) is a chemical compound with molecular formula C17H18BrNO and molecular weight 331.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-bromo-N-propan-2-ylbenzamide
Also Known As: N-benzyl-4-bromo-N-isopropylbenzamide, starbld0028666, N-benzyl-4-bromo-N-propan-2-ylbenzamide, N-benzyl-4-bromo-N-(propan-2-yl)benzamide, N-Benzyl-4-bromo-N-isopropylbenzamide, 97%
| Molecular Formula | C17H18BrNO |
|---|---|
| Molecular Weight | 331.06 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 331.0572 |
| Heavy Atoms | 20 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 349396-01-6 |
|---|---|
| SMILES | CC(C)N(CC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)Br |
| InChIKey | AVXFDACQSAZBAP-UHFFFAOYSA-N |
Product Overview
N-benzyl-4-bromo-N-isopropylbenzamide (CAS 349396-01-6), with molecular formula C17H18BrNO and molecular weight 331.06 g/mol. IUPAC: N-benzyl-4-bromo-N-propan-2-ylbenzamide.
Chemical Property Profile of N-benzyl-4-bromo-N-isopropylbenzamide
Property Insights of N-benzyl-4-bromo-N-isopropylbenzamide
The XLogP value of 4.4 indicates that N-benzyl-4-bromo-N-isopropylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, N-benzyl-4-bromo-N-isopropylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-4-bromo-N-isopropylbenzamide has 0 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-benzyl-4-bromo-N-isopropylbenzamide?
The CAS number of N-benzyl-4-bromo-N-isopropylbenzamide is 349396-01-6.
What is the molecular formula of N-benzyl-4-bromo-N-isopropylbenzamide?
The molecular formula of N-benzyl-4-bromo-N-isopropylbenzamide is C17H18BrNO.
What is the molecular weight of N-benzyl-4-bromo-N-isopropylbenzamide?
The molecular weight of N-benzyl-4-bromo-N-isopropylbenzamide is 331.06 g/mol.
Where can I buy N-benzyl-4-bromo-N-isopropylbenzamide?
You can request a quote for N-benzyl-4-bromo-N-isopropylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-4-bromo-N-isopropylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-4-bromo-N-isopropylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.