6-tert-butyl-2-[(E)-[(2,3-dimethoxyphenyl)methylidene]amino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

6-tert-butyl-2-[(E)-[(2,3-dimethoxyphenyl)methylidene]amino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C29H34N2O4S

SMILES: COC1=CC=C(NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)N=CC2=CC=CC(OC)=C2OC)C=C1

IUPAC: 6-tert-butyl-2-[(E)-[(2,3-dimethoxyphenyl)methylidene]amino]-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1/C29H34N2O4S/c1-29(2,3)19-10-15-22-24(16-19)36-28(30-17-18-8-7-9-23(34-5)26(18)35-6)25(22)27(32)31-20-11-13-21(33-4)14-12-20/h7-9,11-14,17,19H,10,15-16H2,1-6H3,(H,31,32)/b30-17+

Composition: C (68.75%), H (6.76%), N (5.53%), O (12.63%), S (6.33%)

Molar Mass: 506.66

Atom Count: 70

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	506.223928757
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XIGRMYSUICYHGW-OCSSWDANNA-N
Lipinski's Rule of Five
Molar Refractivity	148.17
Topological Polar Surface Area	69.15
Polarizability	55.15
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H34N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00