TL;DR: 2-Thiophenecarboxamide, N-heptyl- (CAS 122020-55-7) is a chemical compound with molecular formula C12H19NOS and molecular weight 225.11873 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-heptylthiophene-2-carboxamide
Also Known As: N-heptylthiophene-2-carboxamide, N-heptyl-2-thiophenecarboxamide, 2-Thiophenecarboxamide, N-heptyl-
| Molecular Formula | C12H19NOS |
| Molecular Weight | 225.11873 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 57.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 225.11873 Da |
| Heavy Atoms | 15 |
| Complexity | 184.0 |
| SMILES | CCCCCCCNC(=O)C1=CC=CS1 |
| InChIKey | RDEFPUMRXJGWKH-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that 2-Thiophenecarboxamide, N-heptyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.3 Ų, 2-Thiophenecarboxamide, N-heptyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thiophenecarboxamide, N-heptyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Thiophenecarboxamide, N-heptyl- is 122020-55-7.
The molecular formula of 2-Thiophenecarboxamide, N-heptyl- is C12H19NOS.
The molecular weight of 2-Thiophenecarboxamide, N-heptyl- is 225.11873 g/mol.
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