(3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone
TL;DR: (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone (CAS 438532-64-0) is a chemical compound with molecular formula C13H11Cl2NO2S and molecular weight 314.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone
Also Known As: (3,4-dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone, 3,4-dichlorobenzo[b]thiophen-2-yl morpholin-4-yl ketone, 4-[(3,4-dichloro-1-benzothien-2-yl)carbonyl]morpholine, (3,4-dichloro-1-benzothiophen-2-yl)(morpholin-4-yl)methanone, (3,4-DICHLORO-1-BENZOTHIOPHEN-2-YL)(MORPHOLINO)METHANONE
| Molecular Formula | C13H11Cl2NO2S |
|---|---|
| Molecular Weight | 314.99 g/mol |
| LogP | 3.6805 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.98877 |
| Heavy Atoms | 19 |
| Complexity | 634.8501 |
Chemical Identifiers
| CAS Number | 438532-64-0 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=C(C3=C(S2)C=CC=C3Cl)Cl |
Product Overview
(3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone (CAS 438532-64-0), with molecular formula C13H11Cl2NO2S and molecular weight 314.99 g/mol. IUPAC: (3,4-dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone.
Chemical Property Profile of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone
Property Insights of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone
The XLogP value of 3.6805 indicates that (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone has 0 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 (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone?
The CAS number of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone is 438532-64-0.
What is the molecular formula of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone?
The molecular formula of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone is C13H11Cl2NO2S.
What is the molecular weight of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone?
The molecular weight of (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone is 314.99 g/mol.
Where can I buy (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone?
You can request a quote for (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dichloro-1-benzothiophen-2-yl)-morpholin-4-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.