TL;DR: 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 1188375-25-8) is a chemical compound with molecular formula C12H16N2OS and molecular weight 236.09833 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 6284AE, 5-(5-Chloro-thiophen-2-yl)-2H-pyrazole-3-carboxylic acid, 2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid cyclopropylamide, 2-amino-N-cyclopropyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
| Molecular Formula | C12H16N2OS |
| Molecular Weight | 236.09833 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 83.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.09833 Da |
| Heavy Atoms | 16 |
| Complexity | 293.0 |
| SMILES | C1CCC2=C(C1)C(=C(S2)N)C(=O)NC3CC3 |
| InChIKey | JVFADEBFYSTPSE-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide. Following Lipinski's Rule of Five, 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 1188375-25-8.
The molecular formula of 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is C12H16N2OS.
The molecular weight of 2-amino-N-cyclopropyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 236.09833 g/mol.
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