3-Chloro-N-heptylbenzamide
TL;DR: 3-Chloro-N-heptylbenzamide (CAS 302909-51-9) is a chemical compound with molecular formula C14H20ClNO and molecular weight 253.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-heptylbenzamide
Also Known As: 3-chloro-N-heptylbenzamide, 3-chloro-N-heptyl-benzamide, Benzamide, 3-chloro-N-heptyl-, (3-chlorophenyl)-N-heptylcarboxamide, 657-597-1
| Molecular Formula | C14H20ClNO |
|---|---|
| Molecular Weight | 253.12 g/mol |
| LogP | 4.0402 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 253.12334 |
| Heavy Atoms | 17 |
| Complexity | 351.83038 |
Chemical Identifiers
| CAS Number | 302909-51-9 |
|---|---|
| SMILES | CCCCCCCNC(=O)C1=CC(=CC=C1)Cl |
Product Overview
3-Chloro-N-heptylbenzamide (CAS 302909-51-9), with molecular formula C14H20ClNO and molecular weight 253.12 g/mol. IUPAC: 3-chloro-N-heptylbenzamide.
Chemical Property Profile of 3-Chloro-N-heptylbenzamide
Property Insights of 3-Chloro-N-heptylbenzamide
The XLogP value of 4.0402 indicates that 3-Chloro-N-heptylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Chloro-N-heptylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-N-heptylbenzamide 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 3-Chloro-N-heptylbenzamide?
The CAS number of 3-Chloro-N-heptylbenzamide is 302909-51-9.
What is the molecular formula of 3-Chloro-N-heptylbenzamide?
The molecular formula of 3-Chloro-N-heptylbenzamide is C14H20ClNO.
What is the molecular weight of 3-Chloro-N-heptylbenzamide?
The molecular weight of 3-Chloro-N-heptylbenzamide is 253.12 g/mol.
Where can I buy 3-Chloro-N-heptylbenzamide?
You can request a quote for 3-Chloro-N-heptylbenzamide 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-heptylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-N-heptylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.