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4-chloro-N-[1-(N'-hydroxycarbamimidoyl)cyclohexyl]benzamide

4-chloro-N-[1-(N'-hydroxycarbamimidoyl)cyclohexyl]benzamide

CAS: 912763-51-0

Formula: C14H18ClN3O2

SMILES: NC(=NO)C1(CCCCC1)NC(=O)C1=CC=C(Cl)C=C1

IUPAC: 4-chloro-N-[1-(N'-hydroxycarbamimidoyl)cyclohexyl]benzamide

InChI: InChI=1S/C14H18ClN3O2/c15-11-6-4-10(5-7-11)12(19)17-14(13(16)18-20)8-2-1-3-9-14/h4-7,20H,1-3,8-9H2,(H2,16,18)(H,17,19)

Composition: C (56.85%), H (6.13%), Cl (11.99%), N (14.21%), O (10.82%)

Molar Mass: 295.77

Atom Count: 38

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 295.1087545
Formal Charge 0
FSP3 0.43
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey XVQAYPPJXZBDCR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.74
Topological Polar Surface Area 87.71
Polarizability 29.79
Ring Count 2
Rotatable Bond Count 3

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