N-[3-(1H-indol-2-ylformamido)propyl]-2-(4-nitrophenoxy)acetamide

N-[3-(1H-indol-2-ylformamido)propyl]-2-(4-nitrophenoxy)acetamide

Formula: C20H20N4O5

SMILES: [O-][N+](=O)C1=CC=C(OCC(=O)NCCCNC(=O)C2=CC3=CC=CC=C3N2)C=C1

IUPAC: N-{3-[(1H-indol-2-yl)formamido]propyl}-2-(4-nitrophenoxy)acetamide

InChI: InChI=1S/C20H20N4O5/c25-19(13-29-16-8-6-15(7-9-16)24(27)28)21-10-3-11-22-20(26)18-12-14-4-1-2-5-17(14)23-18/h1-2,4-9,12,23H,3,10-11,13H2,(H,21,25)(H,22,26)

Composition: C (60.60%), H (5.09%), N (14.13%), O (20.18%)

Molar Mass: 396.403

Atom Count: 49

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	396.14336976
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	WJLAJPLDMYLZHW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.54
Topological Polar Surface Area	126.36
Polarizability	40.93
Ring Count	3
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H20N4O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00