(Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide
TL;DR: (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide (CAS 877794-69-9) is a chemical compound with molecular formula C20H19NO2S and molecular weight 337.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]-N-phenylbutanamide
Also Known As: (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide, 3-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]-N-phenylbutanamide, 3-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]-N-phenylbutanamide
| Molecular Formula | C20H19NO2S |
|---|---|
| Molecular Weight | 337.11 g/mol |
| LogP | 4.8957 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.11365 |
| Heavy Atoms | 24 |
| Complexity | 796.29596 |
Chemical Identifiers
| CAS Number | 877794-69-9 |
|---|---|
| SMILES | CC(C)CC(=O)N(/C=C\1/C(=O)C2=CC=CC=C2S1)C3=CC=CC=C3 |
Product Overview
(Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide (CAS 877794-69-9), with molecular formula C20H19NO2S and molecular weight 337.11 g/mol. IUPAC: 3-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]-N-phenylbutanamide.
Chemical Property Profile of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide
Property Insights of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide
The XLogP value of 4.8957 indicates that (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide 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 (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide?
The CAS number of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide is 877794-69-9.
What is the molecular formula of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide?
The molecular formula of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide is C20H19NO2S.
What is the molecular weight of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide?
The molecular weight of (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide is 337.11 g/mol.
Where can I buy (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide?
You can request a quote for (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)-N-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.