N-(2-ethoxyphenyl)-2-(2-phenylacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

N-(2-ethoxyphenyl)-2-(2-phenylacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

Formula: C26H28N2O3S

SMILES: CCOC1=CC=CC=C1NC(=O)C1=C(NC(=O)CC2=CC=CC=C2)SC2=C1CCCCC2

IUPAC: N-(2-ethoxyphenyl)-2-(2-phenylacetamido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

InChI: InChI=1S/C26H28N2O3S/c1-2-31-21-15-10-9-14-20(21)27-25(30)24-19-13-7-4-8-16-22(19)32-26(24)28-23(29)17-18-11-5-3-6-12-18/h3,5-6,9-12,14-15H,2,4,7-8,13,16-17H2,1H3,(H,27,30)(H,28,29)

Composition: C (69.62%), H (6.29%), N (6.25%), O (10.70%), S (7.15%)

Molar Mass: 448.58

Atom Count: 60

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	448.182063944
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	YXIKOWFWEIKLDC-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	130.68
Topological Polar Surface Area	67.43
Polarizability	48.76
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H28N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00