N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)oxolane-2-carboxamide

N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)oxolane-2-carboxamide

Formula: C18H24N2O2S

SMILES: CC(C)(C)C1CCC2=C(C1)SC(NC(=O)C1CCCO1)=C2C#N

IUPAC: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)oxolane-2-carboxamide

InChI: InChI=1/C18H24N2O2S/c1-18(2,3)11-6-7-12-13(10-19)17(23-15(12)9-11)20-16(21)14-5-4-8-22-14/h11,14H,4-9H2,1-3H3,(H,20,21)

Composition: C (65.03%), H (7.28%), N (8.43%), O (9.62%), S (9.64%)

Molar Mass: 332.46

Atom Count: 47

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	332.155849195
Formal Charge	0
FSP3	0.67
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KMILGOZZOHHFHY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.24
Topological Polar Surface Area	62.12
Polarizability	35.05
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H24N2O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00