N-(2,5-dimethoxyphenyl)-2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

N-(2,5-dimethoxyphenyl)-2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

Formula: C28H34N2O6S

SMILES: COC1=CC=C(OC)C(NC(=O)C2=C(NCC3=CC=C(OC)C(OC)=C3OC)SC3=C2CCCCC3)=C1

IUPAC: N-(2,5-dimethoxyphenyl)-2-{[(2,3,4-trimethoxyphenyl)methyl]amino}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

InChI: InChI=1S/C28H34N2O6S/c1-32-18-12-14-21(33-2)20(15-18)30-27(31)24-19-9-7-6-8-10-23(19)37-28(24)29-16-17-11-13-22(34-3)26(36-5)25(17)35-4/h11-15,29H,6-10,16H2,1-5H3,(H,30,31)

Composition: C (63.86%), H (6.51%), N (5.32%), O (18.23%), S (6.09%)

Molar Mass: 526.65

Atom Count: 71

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	526.213757997
Formal Charge	0
FSP3	0.39
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	VXSMZUOKARAOQM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	147
Topological Polar Surface Area	87.28
Polarizability	55.11
Ring Count	4
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H34N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00