C19H20Cl2N2O2S
TL;DR: C19H20Cl2N2O2S (CAS 1049700-01-7) is a chemical compound with molecular formula C19H20Cl2N2O2S and molecular weight 410.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-1-pyridin-3-ylmethanamine;hydrochloride
Also Known As: N-(3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)benzyl)-1-(pyridin-3-yl)methanamine hydrochloride, N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-1-pyridin-3-ylmethanamine hydrochloride
| Molecular Formula | C19H20Cl2N2O2S |
|---|---|
| Molecular Weight | 410.06 g/mol |
| LogP | 5.0957 |
| Topological Polar Surface Area | 43.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.06226 |
| Heavy Atoms | 26 |
| Complexity | 798.8086 |
Chemical Identifiers
| CAS Number | 1049700-01-7 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)CNCC2=CN=CC=C2)Cl)OCC3=CC=CS3.Cl |
Product Overview
C19H20Cl2N2O2S (CAS 1049700-01-7), with molecular formula C19H20Cl2N2O2S and molecular weight 410.06 g/mol. IUPAC: N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-1-pyridin-3-ylmethanamine;hydrochloride.
Chemical Property Profile of C19H20Cl2N2O2S
Property Insights of C19H20Cl2N2O2S
The XLogP value of 5.0957 indicates that C19H20Cl2N2O2S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.38 Ų, C19H20Cl2N2O2S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C19H20Cl2N2O2S has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C19H20Cl2N2O2S?
The CAS number of C19H20Cl2N2O2S is 1049700-01-7.
What is the molecular formula of C19H20Cl2N2O2S?
The molecular formula of C19H20Cl2N2O2S is C19H20Cl2N2O2S.
What is the molecular weight of C19H20Cl2N2O2S?
The molecular weight of C19H20Cl2N2O2S is 410.06 g/mol.
Where can I buy C19H20Cl2N2O2S?
You can request a quote for C19H20Cl2N2O2S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H20Cl2N2O2S?
Yes, KEHONG BIO provides custom synthesis services for C19H20Cl2N2O2S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.