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

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

Formula: C18H20N2O2S

SMILES: CC1=CC=CC=C1C(=O)NC1=C(C(N)=O)C2=C(CCCCC2)S1

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

InChI: InChI=1S/C18H20N2O2S/c1-11-7-5-6-8-12(11)17(22)20-18-15(16(19)21)13-9-3-2-4-10-14(13)23-18/h5-8H,2-4,9-10H2,1H3,(H2,19,21)(H,20,22)

Composition: C (65.83%), H (6.14%), N (8.53%), O (9.74%), S (9.76%)

Molar Mass: 328.43

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	328.124549066
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	KXGOGRVRFZNLLJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	94
Topological Polar Surface Area	72.19
Polarizability	34.53
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20N2O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00