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N-cyclopropyl-3-{5-[(propylamino)methyl]-1,2,4-oxadiazol-3-yl}benzamide hydrochloride

N-cyclopropyl-3-{5-[(propylamino)methyl]-1,2,4-oxadiazol-3-yl}benzamide hydrochloride

CAS: 1185299-52-8

Formula: C16H21ClN4O2

SMILES: Cl.CCCNCC1=NC(=NO1)C1=CC=CC(=C1)C(=O)NC1CC1

IUPAC: N-cyclopropyl-3-{5-[(propylamino)methyl]-1,2,4-oxadiazol-3-yl}benzamide hydrochloride

InChI: InChI=1S/C16H20N4O2.ClH/c1-2-8-17-10-14-19-15(20-22-14)11-4-3-5-12(9-11)16(21)18-13-6-7-13;/h3-5,9,13,17H,2,6-8,10H2,1H3,(H,18,21);1H

Composition: C (57.06%), H (6.28%), Cl (10.52%), N (16.63%), O (9.50%)

Molar Mass: 336.82

Atom Count: 44

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 336.1353036
Formal Charge 0
FSP3 0.44
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey WAYICYYEFBAUIT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 95.12
Topological Polar Surface Area 80.05
Polarizability 32.24
Ring Count 3
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1185299-52-8 $336.89$336.89
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