N-(2-{[4-(morpholin-4-yl)-3-nitrophenyl]formamido}ethyl)pyrazine-2-carboxamide

N-(2-{[4-(morpholin-4-yl)-3-nitrophenyl]formamido}ethyl)pyrazine-2-carboxamide

Formula: C18H20N6O5

SMILES: [O-][N+](=O)C1=CC(=CC=C1N1CCOCC1)C(=O)NCCNC(=O)C1=CN=CC=N1

IUPAC: N-(2-{[4-(morpholin-4-yl)-3-nitrophenyl]formamido}ethyl)pyrazine-2-carboxamide

InChI: InChI=1S/C18H20N6O5/c25-17(21-5-6-22-18(26)14-12-19-3-4-20-14)13-1-2-15(16(11-13)24(27)28)23-7-9-29-10-8-23/h1-4,11-12H,5-10H2,(H,21,25)(H,22,26)

Composition: C (54.00%), H (5.04%), N (20.99%), O (19.98%)

Molar Mass: 400.395

Atom Count: 49

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	400.149517768
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	GHVCGPKEPZZCTD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	103.23
Topological Polar Surface Area	139.59
Polarizability	37.99
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H20N6O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00