AC1MK3BU
N-[6-tert-butyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide
Also Known As: ChemDiv2_004121|Oprea1_523749|Oprea1_718096|BAS 03715985|IDI1_002836|AP-064/15228181|SR-01000494969-1|N-[6-tert-butyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide|Furan-2-carboxylic acid [6-tert-butyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahy|N-[6-tert-butyl-3-(1-pyrrolidinylcarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]-2-furamide|N-[6-tert-butyl-3-(pyrrolidin-1-ylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide
| Molecular Formula | C22H28N2O3S |
|---|---|
| Molecular Weight | 400.18207 g/mol |
| LogP | 4.9804 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.18207 |
| Monoisotopic Mass | 400.18207 |
| Heavy Atoms | 28 |
| Complexity | 870.4743 |
Chemical Identifiers
| CAS Number | 407585-01-7 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N3CCCC3)NC(=O)C4=CC=CO4 |
Product Overview
AC1MK3BU (CAS 407585-01-7), with molecular formula C22H28N2O3S and molecular weight 400.18207 g/mol. IUPAC: N-[6-tert-butyl-3-(pyrrolidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide.
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