4-(bromomethyl)-N-propan-2-ylbenzamide
TL;DR: 4-(bromomethyl)-N-propan-2-ylbenzamide (CAS 64580-41-2) is a chemical compound with molecular formula C11H14BrNO and molecular weight 255.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(bromomethyl)-N-propan-2-ylbenzamide
Also Known As: 4-(bromomethyl)-N-propan-2-ylbenzamide, 4- -N- BENZAMIDE, 4-(bromomethyl)-N-isopropylbenzamide, 4-(Bromomethyl)-N-(propan-2-yl)benzamide, 4-(Bromomethyl)-N-(l-methylethyl)benzamide
| Molecular Formula | C11H14BrNO |
|---|---|
| Molecular Weight | 255.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.02588 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 64580-41-2 |
|---|---|
| SMILES | CC(C)NC(=O)C1=CC=C(C=C1)CBr |
| InChIKey | CSIBQQXQVWSHML-UHFFFAOYSA-N |
Product Overview
4-(bromomethyl)-N-propan-2-ylbenzamide (CAS 64580-41-2), with molecular formula C11H14BrNO and molecular weight 255.03 g/mol. IUPAC: 4-(bromomethyl)-N-propan-2-ylbenzamide.
Chemical Property Profile of 4-(bromomethyl)-N-propan-2-ylbenzamide
Property Insights of 4-(bromomethyl)-N-propan-2-ylbenzamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(bromomethyl)-N-propan-2-ylbenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, 4-(bromomethyl)-N-propan-2-ylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(bromomethyl)-N-propan-2-ylbenzamide 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 4-(bromomethyl)-N-propan-2-ylbenzamide?
The CAS number of 4-(bromomethyl)-N-propan-2-ylbenzamide is 64580-41-2.
What is the molecular formula of 4-(bromomethyl)-N-propan-2-ylbenzamide?
The molecular formula of 4-(bromomethyl)-N-propan-2-ylbenzamide is C11H14BrNO.
What is the molecular weight of 4-(bromomethyl)-N-propan-2-ylbenzamide?
The molecular weight of 4-(bromomethyl)-N-propan-2-ylbenzamide is 255.03 g/mol.
Where can I buy 4-(bromomethyl)-N-propan-2-ylbenzamide?
You can request a quote for 4-(bromomethyl)-N-propan-2-ylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(bromomethyl)-N-propan-2-ylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(bromomethyl)-N-propan-2-ylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.