1-butoxy-3-[4-(2,4-dinitrophenyl)piperazin-1-yl]propan-2-ol

1-butoxy-3-[4-(2,4-dinitrophenyl)piperazin-1-yl]propan-2-ol

Formula: C17H26N4O6

SMILES: CCCCOCC(O)CN1CCN(CC1)C1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

IUPAC: 1-butoxy-3-[4-(2,4-dinitrophenyl)piperazin-1-yl]propan-2-ol

InChI: InChI=1/C17H26N4O6/c1-2-3-10-27-13-15(22)12-18-6-8-19(9-7-18)16-5-4-14(20(23)24)11-17(16)21(25)26/h4-5,11,15,22H,2-3,6-10,12-13H2,1H3

Composition: C (53.39%), H (6.85%), N (14.65%), O (25.10%)

Molar Mass: 382.417

Atom Count: 53

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	382.185234573
Formal Charge	0
FSP3	0.65
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
InChIKey	WPTDIOVWVGGHEZ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.06
Topological Polar Surface Area	122.22
Polarizability	37.67
Ring Count	2
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H26N4O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00