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4-{[bis(pyrazin-2-yl)amino]methyl}-N-hydroxybenzamide

4-{[bis(pyrazin-2-yl)amino]methyl}-N-hydroxybenzamide

CAS: 1636894-46-6

Formula: C16H14N6O2

SMILES: ONC(=O)C1=CC=C(CN(C2=NC=CN=C2)C2=NC=CN=C2)C=C1

IUPAC: 4-{[bis(pyrazin-2-yl)amino]methyl}-N-hydroxybenzamide

InChI: InChI=1S/C16H14N6O2/c23-16(21-24)13-3-1-12(2-4-13)11-22(14-9-17-5-7-19-14)15-10-18-6-8-20-15/h1-10,24H,11H2,(H,21,23)

Composition: C (59.62%), H (4.38%), N (26.07%), O (9.93%)

Molar Mass: 322.328

Atom Count: 38

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 322.117823715
Formal Charge 0
FSP3 0.06
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 2
InChIKey LXHMTDHBMRZSHJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.9
Topological Polar Surface Area 104.13
Polarizability 32.39
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98.09% <7 Days 1636894-46-6 $224.40-$1,870.00$224.40$364.65$729.30$1,168.75$1,870.00
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Molnova Chemicals
Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 1636894-46-6 $246.14-$3,997.05$246.14$409.72$779.69$1,206.22$1,775.70$2,663.93$3,997.05
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