Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone
TL;DR: Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone (CAS 690677-86-2) is a chemical compound with molecular formula C13H10Cl3NO2S and molecular weight 348.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone
Also Known As: morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone, morpholin-4-yl(3,4,6-trichloro-1-benzothiophen-2-yl)methanone, Cambridge id 7100023
| Molecular Formula | C13H10Cl3NO2S |
|---|---|
| Molecular Weight | 348.95 g/mol |
| LogP | 4.3339 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 348.94977 |
| Heavy Atoms | 20 |
| Complexity | 679.7964 |
Chemical Identifiers
| CAS Number | 690677-86-2 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=C(C3=C(S2)C=C(C=C3Cl)Cl)Cl |
Product Overview
Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone (CAS 690677-86-2), with molecular formula C13H10Cl3NO2S and molecular weight 348.95 g/mol. IUPAC: morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone.
Chemical Property Profile of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone
Property Insights of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone
The XLogP value of 4.3339 indicates that Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone 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 Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone?
The CAS number of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone is 690677-86-2.
What is the molecular formula of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone?
The molecular formula of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone is C13H10Cl3NO2S.
What is the molecular weight of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone?
The molecular weight of Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone is 348.95 g/mol.
Where can I buy Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone?
You can request a quote for Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for Morpholin-4-yl-(3,4,6-trichloro-1-benzothiophen-2-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.