N-[3-(benzyloxy)pyridin-2-yl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-sulfonamide

N-[3-(benzyloxy)pyridin-2-yl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-sulfonamide

CAS: 1022784-39-9

Formula: C21H24N2O4S

SMILES: CC1(C)C2CCC1(C(=O)C2)S(=O)(=O)NC1=NC=CC=C1OCC1=CC=CC=C1

IUPAC: N-[3-(benzyloxy)pyridin-2-yl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-sulfonamide

InChI: InChI=1/C21H24N2O4S/c1-20(2)16-10-11-21(20,18(24)13-16)28(25,26)23-19-17(9-6-12-22-19)27-14-15-7-4-3-5-8-15/h3-9,12,16H,10-11,13-14H2,1-2H3,(H,22,23)

Composition: C (62.98%), H (6.04%), N (6.99%), O (15.98%), S (8.01%)

Molar Mass: 400.49

Atom Count: 52

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	400.145678435
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	LPDWDSNRRKEFEG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	105.47
Topological Polar Surface Area	85.36
Polarizability	42.03
Ring Count	4
Rotatable Bond Count	5

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90%	<2 Days	1022784-39-9		$51.35-$86.31$51.35$63.37$86.31