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N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide
TL;DR: N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide (CAS 339100-08-2) is a chemical compound with molecular formula C16H16ClNOS and molecular weight 305.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)sulfanylethyl]-2-methylbenzamide
Also Known As: 8L-539S, N-[2-(4-chlorophenyl)sulfanylethyl]-2-methylbenzamide, N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzamide, N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide, N-[2-(4-chlorophenyl)sulfanylethyl]-2-methyl-benzamide
| Molecular Formula | C16H16ClNOS |
|---|---|
| Molecular Weight | 305.06 g/mol |
| LogP | 4.17052 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.06412 |
| Heavy Atoms | 20 |
| Complexity | 583.28564 |
Chemical Identifiers
| CAS Number | 339100-08-2 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NCCSC2=CC=C(C=C2)Cl |
Product Overview
N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide (CAS 339100-08-2), with molecular formula C16H16ClNOS and molecular weight 305.06 g/mol. IUPAC: N-[2-(4-chlorophenyl)sulfanylethyl]-2-methylbenzamide.
Chemical Property Profile of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide
Property Insights of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide
The XLogP value of 4.17052 indicates that N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide has 1 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 N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide?
The CAS number of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide is 339100-08-2.
What is the molecular formula of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide?
The molecular formula of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide is C16H16ClNOS.
What is the molecular weight of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide?
The molecular weight of N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide is 305.06 g/mol.
Where can I buy N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide?
You can request a quote for N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2-methylbenzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.