![N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine structure](/static/products/4339/433950-30-2.webp)
N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine
TL;DR: N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine (CAS 433950-30-2) is a chemical compound with molecular formula C12H18ClNOS and molecular weight 259.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)sulfanylethyl]-3-methoxypropan-1-amine
Also Known As: CHEMBRDG-BB 7013869, CHEMBRDG-BB7013869, 3-chloro-5-difluoromethoxybenzaldehyde, N-{2-[(4-CHLOROPHENYL)THIO]ETHYL}-3-METHOXYPROPAN-1-AMINE, N-[2-(4-chlorophenyl)sulfanylethyl]-3-methoxypropan-1-amine
| Molecular Formula | C12H18ClNOS |
|---|---|
| Molecular Weight | 259.08 g/mol |
| LogP | 3.0582 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 259.07977 |
| Heavy Atoms | 16 |
| Complexity | 278.85217 |
Chemical Identifiers
| CAS Number | 433950-30-2 |
|---|---|
| SMILES | COCCCNCCSC1=CC=C(C=C1)Cl |
Product Overview
N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine (CAS 433950-30-2), with molecular formula C12H18ClNOS and molecular weight 259.08 g/mol. IUPAC: N-[2-(4-chlorophenyl)sulfanylethyl]-3-methoxypropan-1-amine.
Chemical Property Profile of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine
Property Insights of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine
The XLogP value of 3.0582 indicates that N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine 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-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine?
The CAS number of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine is 433950-30-2.
What is the molecular formula of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine?
The molecular formula of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine is C12H18ClNOS.
What is the molecular weight of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine?
The molecular weight of N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine is 259.08 g/mol.
Where can I buy N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine?
You can request a quote for N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine 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)thio]ethyl}-3-methoxypropan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(4-Chlorophenyl)thio]ethyl}-3-methoxypropan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.