![N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide structure](/static/products/522/522596-46-9.png)
N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
TL;DR: N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 522596-46-9) is a chemical compound with molecular formula C23H32N4OS and molecular weight 412.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-cyclohexyl-2-{[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-cyclohexyl-2-{[(E)-(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, {2-[(1E)-2-(1-ethyl-5-methylpyrazol-4-yl)-1-azavinyl]-6-methyl(4,5,6,7-tetrahy drobenzo[b]thiophen-3-yl)}-N-cyclohexylcarboxamide
| Molecular Formula | C23H32N4OS |
|---|---|
| Molecular Weight | 412.23 g/mol |
| LogP | 5.21082 |
| Topological Polar Surface Area | 59.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.22968 |
| Heavy Atoms | 29 |
| Complexity | 904.3648 |
Chemical Identifiers
| CAS Number | 522596-46-9 |
|---|---|
| SMILES | CCN1C(=C(C=N1)/C=N/C2=C(C3=C(S2)CC(CC3)C)C(=O)NC4CCCCC4)C |
Product Overview
N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 522596-46-9), with molecular formula C23H32N4OS and molecular weight 412.23 g/mol. IUPAC: N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Property Insights of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
The XLogP value of 5.21082 indicates that N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.28 Ų, N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The CAS number of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 522596-46-9.
What is the molecular formula of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular formula of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is C23H32N4OS.
What is the molecular weight of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular weight of N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 412.23 g/mol.
Where can I buy N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
You can request a quote for N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-cyclohexyl-2-[(E)-(1-ethyl-5-methylpyrazol-4-yl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.