(4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone
TL;DR: (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone (CAS 898141-17-8) is a chemical compound with molecular formula C15H22N2OS and molecular weight 278.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone
Also Known As: (4-methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone, (4-methyl-1,4-diazepan-1-yl)(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone, (4-methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydrobenzothiophen-3-yl)methanone, 4-methyl(1,4-diazaperhydroepinyl) 4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl keto ne
| Molecular Formula | C15H22N2OS |
|---|---|
| Molecular Weight | 278.15 g/mol |
| LogP | 2.4046 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.1453 |
| Heavy Atoms | 19 |
| Complexity | 468.71066 |
Chemical Identifiers
| CAS Number | 898141-17-8 |
|---|---|
| SMILES | CN1CCCN(CC1)C(=O)C2=CSC3=C2CCCC3 |
Product Overview
(4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone (CAS 898141-17-8), with molecular formula C15H22N2OS and molecular weight 278.15 g/mol. IUPAC: (4-methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone.
Chemical Property Profile of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone
Property Insights of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone
The XLogP value of 2.4046 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone. With a topological polar surface area (TPSA) of 23.55 Ų, (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-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 (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone?
The CAS number of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone is 898141-17-8.
What is the molecular formula of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone?
The molecular formula of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone is C15H22N2OS.
What is the molecular weight of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone?
The molecular weight of (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone is 278.15 g/mol.
Where can I buy (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone?
You can request a quote for (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Methyl-1,4-diazepan-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.