Text Search
Structure Search

N-{2-[2-(2-azidoethoxy)ethoxy]ethyl}-6-{[(tert-butoxycarbonyl)amino]amino}pyridine-3-carboxamide

N-{2-[2-(2-azidoethoxy)ethoxy]ethyl}-6-{[(tert-butoxycarbonyl)amino]amino}pyridine-3-carboxamide

CAS: 2742971-89-5

Formula: C17H27N7O5

SMILES: CC(C)(C)OC(=O)NNC1=NC=C(C=C1)C(=O)NCCOCCOCCN=[N+]=[N-]

IUPAC: N-{2-[2-(2-azidoethoxy)ethoxy]ethyl}-6-({[(tert-butoxy)carbonyl]amino}amino)pyridine-3-carboxamide

InChI: InChI=1S/C17H27N7O5/c1-17(2,3)29-16(26)23-22-14-5-4-13(12-20-14)15(25)19-6-8-27-10-11-28-9-7-21-24-18/h4-5,12H,6-11H2,1-3H3,(H,19,25)(H,20,22)(H,23,26)

Composition: C (49.87%), H (6.65%), N (23.95%), O (19.54%)

Molar Mass: 409.447

Atom Count: 56

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 409.207366997
Formal Charge 0
FSP3 0.59
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 3
InChIKey RZGJXNKMOCHQAT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 106.38
Topological Polar Surface Area 140.24
Polarizability 39.39
Ring Count 1
Rotatable Bond Count 14

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2742971-89-5 $387.45-$1,285.20$387.45$774.90$1,285.20
Request Quote