ethyl 2-{[1,1'-biphenyl]-4-amido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-{[1,1'-biphenyl]-4-amido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula: C24H23NO3S

SMILES: CCOC(=O)C1=C(NC(=O)C2=CC=C(C=C2)C2=CC=CC=C2)SC2=C1CCCC2

IUPAC: ethyl 2-{[1,1'-biphenyl]-4-amido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1S/C24H23NO3S/c1-2-28-24(27)21-19-10-6-7-11-20(19)29-23(21)25-22(26)18-14-12-17(13-15-18)16-8-4-3-5-9-16/h3-5,8-9,12-15H,2,6-7,10-11H2,1H3,(H,25,26)

Composition: C (71.09%), H (5.72%), N (3.45%), O (11.84%), S (7.91%)

Molar Mass: 405.51

Atom Count: 52

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	405.139864779
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	IMUYQGUYCJASNQ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	117.19
Topological Polar Surface Area	55.4
Polarizability	45.3
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H23NO3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00