N-isopropyl-3,4-dimethoxybenzamide
TL;DR: N-isopropyl-3,4-dimethoxybenzamide (CAS 42419-95-4) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethoxy-N-propan-2-ylbenzamide
Also Known As: N-isopropyl-3,4-dimethoxybenzamide, 3,4-dimethoxy-N-propan-2-ylbenzamide, 3,4-dimethoxy-N-propan-2-yl-benzamide, (3,4-dimethoxyphenyl)-N-(methylethyl)carboxamide
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 1.842 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 374.52667 |
Chemical Identifiers
| CAS Number | 42419-95-4 |
|---|---|
| SMILES | CC(C)NC(=O)C1=CC(=C(C=C1)OC)OC |
Product Overview
N-isopropyl-3,4-dimethoxybenzamide (CAS 42419-95-4), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: 3,4-dimethoxy-N-propan-2-ylbenzamide.
Chemical Property Profile of N-isopropyl-3,4-dimethoxybenzamide
Property Insights of N-isopropyl-3,4-dimethoxybenzamide
The XLogP value of 1.842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isopropyl-3,4-dimethoxybenzamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-isopropyl-3,4-dimethoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isopropyl-3,4-dimethoxybenzamide has 1 hydrogen bond donor(s) and 3 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-isopropyl-3,4-dimethoxybenzamide?
The CAS number of N-isopropyl-3,4-dimethoxybenzamide is 42419-95-4.
What is the molecular formula of N-isopropyl-3,4-dimethoxybenzamide?
The molecular formula of N-isopropyl-3,4-dimethoxybenzamide is C12H17NO3.
What is the molecular weight of N-isopropyl-3,4-dimethoxybenzamide?
The molecular weight of N-isopropyl-3,4-dimethoxybenzamide is 223.12 g/mol.
Where can I buy N-isopropyl-3,4-dimethoxybenzamide?
You can request a quote for N-isopropyl-3,4-dimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isopropyl-3,4-dimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-isopropyl-3,4-dimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.