ethyl 2-dodecanamido-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-dodecanamido-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula: C25H41NO3S

SMILES: CCCCCCCCCCCC(=O)NC1=C(C(=O)OCC)C2=C(CC(CC)CC2)S1

IUPAC: ethyl 2-dodecanamido-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1/C25H41NO3S/c1-4-7-8-9-10-11-12-13-14-15-22(27)26-24-23(25(28)29-6-3)20-17-16-19(5-2)18-21(20)30-24/h19H,4-18H2,1-3H3,(H,26,27)

Composition: C (68.92%), H (9.49%), N (3.22%), O (11.02%), S (7.36%)

Molar Mass: 435.67

Atom Count: 71

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	435.280715358
Formal Charge	0
FSP3	0.76
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DXKWSFJVEUXPNY-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	126.57
Topological Polar Surface Area	55.4
Polarizability	48.72
Ring Count	2
Rotatable Bond Count	15

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H41NO3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00