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Benzo[b]thiophen-2-yl(morpholino)methanone
TL;DR: Benzo[b]thiophen-2-yl(morpholino)methanone (CAS 68899-44-5) is a chemical compound with molecular formula C13H13NO2S and molecular weight 247.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzothiophen-2-yl(morpholin-4-yl)methanone
Also Known As: Maybridge3_000244, 4-(1-benzothiophene-2-carbonyl)morpholine, benzo[b]thiophen-2-yl(morpholino)methanone, 1-benzothiophen-2-yl(morpholin-4-yl)methanone, IDI1_011631
| Molecular Formula | C13H13NO2S |
|---|---|
| Molecular Weight | 247.07 g/mol |
| LogP | 2.3737 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.0667 |
| Heavy Atoms | 17 |
| Complexity | 510.09796 |
Chemical Identifiers
| CAS Number | 68899-44-5 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=CC3=CC=CC=C3S2 |
Product Overview
Benzo[b]thiophen-2-yl(morpholino)methanone (CAS 68899-44-5), with molecular formula C13H13NO2S and molecular weight 247.07 g/mol. IUPAC: 1-benzothiophen-2-yl(morpholin-4-yl)methanone.
Chemical Property Profile of Benzo[b]thiophen-2-yl(morpholino)methanone
Property Insights of Benzo[b]thiophen-2-yl(morpholino)methanone
The XLogP value of 2.3737 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo[b]thiophen-2-yl(morpholino)methanone. With a topological polar surface area (TPSA) of 29.54 Ų, Benzo[b]thiophen-2-yl(morpholino)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo[b]thiophen-2-yl(morpholino)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 Benzo[b]thiophen-2-yl(morpholino)methanone?
The CAS number of Benzo[b]thiophen-2-yl(morpholino)methanone is 68899-44-5.
What is the molecular formula of Benzo[b]thiophen-2-yl(morpholino)methanone?
The molecular formula of Benzo[b]thiophen-2-yl(morpholino)methanone is C13H13NO2S.
What is the molecular weight of Benzo[b]thiophen-2-yl(morpholino)methanone?
The molecular weight of Benzo[b]thiophen-2-yl(morpholino)methanone is 247.07 g/mol.
Where can I buy Benzo[b]thiophen-2-yl(morpholino)methanone?
You can request a quote for Benzo[b]thiophen-2-yl(morpholino)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo[b]thiophen-2-yl(morpholino)methanone?
Yes, KEHONG BIO provides custom synthesis services for Benzo[b]thiophen-2-yl(morpholino)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.