Text Search
Structure Search

(2E)-1-(4-methylpiperazin-1-yl)-3-(5-nitrofuran-2-yl)prop-2-en-1-one

(2E)-1-(4-methylpiperazin-1-yl)-3-(5-nitrofuran-2-yl)prop-2-en-1-one

CAS: 803647-40-7

Formula: C12H15N3O4

SMILES: CN1CCN(CC1)C(=O)C=CC1=CC=C(O1)[N+]([O-])=O

IUPAC: (2E)-1-(4-methylpiperazin-1-yl)-3-(5-nitrofuran-2-yl)prop-2-en-1-one

InChI: InChI=1S/C12H15N3O4/c1-13-6-8-14(9-7-13)11(16)4-2-10-3-5-12(19-10)15(17)18/h2-5H,6-9H2,1H3/b4-2+

Composition: C (54.33%), H (5.70%), N (15.84%), O (24.12%)

Molar Mass: 265.269

Atom Count: 34

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 265.106255975
Formal Charge 0
FSP3 0.42
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey QKTRIGNWBRHBFV-DUXPYHPUSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.69
Topological Polar Surface Area 79.83
Polarizability 25.65
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Selleck Chemicals
Purity LeadTime CAS UnitPrice
98% <10 Days 803647-40-7 Quote Only
Molnova Chemicals
Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 803647-40-7 $54.27-$1,031.94$54.27$77.97$140.65$288.94$550.37$1,031.94
Request Quote