2-(4-tert-butylbenzamido)-N-(4-phenoxyphenyl)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

2-(4-tert-butylbenzamido)-N-(4-phenoxyphenyl)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

Formula: C31H30N2O3S

SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)NC1=C(C(=O)NC2=CC=C(OC3=CC=CC=C3)C=C2)C2=C(CCC2)S1

IUPAC: 2-(4-tert-butylbenzamido)-N-(4-phenoxyphenyl)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

InChI: InChI=1S/C31H30N2O3S/c1-31(2,3)21-14-12-20(13-15-21)28(34)33-30-27(25-10-7-11-26(25)37-30)29(35)32-22-16-18-24(19-17-22)36-23-8-5-4-6-9-23/h4-6,8-9,12-19H,7,10-11H2,1-3H3,(H,32,35)(H,33,34)

Composition: C (72.91%), H (5.92%), N (5.49%), O (9.40%), S (6.28%)

Molar Mass: 510.65

Atom Count: 67

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	510.197714008
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	WSGBARZHCVRKCO-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	151.12
Topological Polar Surface Area	67.43
Polarizability	56.46
Ring Count	5
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C31H30N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00