5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide
TL;DR: 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide (CAS 862698-91-7) is a chemical compound with molecular formula C14H13NO2S and molecular weight 259.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-N-benzylthiophene-2-carboxamide
Also Known As: 5-acetyl-N-benzylthiophene-2-carboxamide, 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide, 5-acetyl-N-benzyl-2-thiophenecarboxamide
| Molecular Formula | C14H13NO2S |
|---|---|
| Molecular Weight | 259.07 g/mol |
| LogP | 2.8807 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.0667 |
| Heavy Atoms | 18 |
| Complexity | 560.1828 |
Chemical Identifiers
| CAS Number | 862698-91-7 |
|---|---|
| SMILES | CC(=O)C1=CC=C(S1)C(=O)NCC2=CC=CC=C2 |
Product Overview
5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide (CAS 862698-91-7), with molecular formula C14H13NO2S and molecular weight 259.07 g/mol. IUPAC: 5-acetyl-N-benzylthiophene-2-carboxamide.
Chemical Property Profile of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide
Property Insights of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide
The XLogP value of 2.8807 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide. With a topological polar surface area (TPSA) of 46.17 Ų, 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide has 1 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 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide?
The CAS number of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide is 862698-91-7.
What is the molecular formula of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide?
The molecular formula of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide is C14H13NO2S.
What is the molecular weight of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide?
The molecular weight of 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide is 259.07 g/mol.
Where can I buy 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide?
You can request a quote for 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-acetyl-N-(phenylmethyl)-2-thiophenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.