![3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide structure](/static/products/4616/461646-63-9.webp)
3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide
TL;DR: 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide (CAS 461646-63-9) is a chemical compound with molecular formula C18H19ClN2O2 and molecular weight 330.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-methyl-N-[3-(2-methylpropanoylamino)phenyl]benzamide
Also Known As: 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide, AP-970/41349841, 3-chloro-4-methyl-N-[3-(2-methylpropanoylamino)phenyl]benzamide, 3-chloro-4-methyl-N-{3-[(2-methylpropanoyl)amino]phenyl}benzamide
| Molecular Formula | C18H19ClN2O2 |
|---|---|
| Molecular Weight | 330.11 g/mol |
| LogP | 4.49522 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.1135 |
| Heavy Atoms | 23 |
| Complexity | 741.5515 |
Chemical Identifiers
| CAS Number | 461646-63-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C(C)C)Cl |
Product Overview
3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide (CAS 461646-63-9), with molecular formula C18H19ClN2O2 and molecular weight 330.11 g/mol. IUPAC: 3-chloro-4-methyl-N-[3-(2-methylpropanoylamino)phenyl]benzamide.
Chemical Property Profile of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide
Property Insights of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide
The XLogP value of 4.49522 indicates that 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide has 2 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 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide?
The CAS number of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide is 461646-63-9.
What is the molecular formula of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide?
The molecular formula of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide is C18H19ClN2O2.
What is the molecular weight of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide?
The molecular weight of 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide is 330.11 g/mol.
Where can I buy 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide?
You can request a quote for 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-[3-(isobutyrylamino)phenyl]-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.