TL;DR: 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide (CAS 1351482-12-6) is a chemical compound with molecular formula C14H14N2OS2 and molecular weight 290.05475 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-thiophen-2-ylmethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide, (E)-2-((thiophen-2-ylmethylene)amino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide, 2-[(E)-thiophen-2-ylmethylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-{[(E)-thiophen-2-ylmethylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, 2-{(E)-[(Thiophen-2-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C14H14N2OS2 |
| Molecular Weight | 290.05475 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.05475 Da |
| Heavy Atoms | 19 |
| Complexity | 374.0 |
| SMILES | C1CCC2=C(C1)C(=C(S2)/N=C/C3=CC=CS3)C(=O)N |
| InChIKey | VBXIGYKYWIVTLO-LZYBPNLTSA-N |
The XLogP value of 3.4 indicates that 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide. Following Lipinski's Rule of Five, 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide is 1351482-12-6.
The molecular formula of 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide is C14H14N2OS2.
The molecular weight of 2-[(2-thienylmethylene)amino]-4,5,6,7-tetrahydro-1-benzo[b]thiophene-3-carboxamide is 290.05475 g/mol.
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