tert-butyl N-{1-[6-(2-fluorophenyl)pyridazin-3-yl]pyrrolidin-3-yl}carbamate

tert-butyl N-{1-[6-(2-fluorophenyl)pyridazin-3-yl]pyrrolidin-3-yl}carbamate

CAS: 1638612-48-2

Formula: C19H23FN4O2

SMILES: CC(C)(C)OC(=O)NC1CCN(C1)C1=NN=C(C=C1)C1=C(F)C=CC=C1

IUPAC: tert-butyl N-{1-[6-(2-fluorophenyl)pyridazin-3-yl]pyrrolidin-3-yl}carbamate

InChI: InChI=1/C19H23FN4O2/c1-19(2,3)26-18(25)21-13-10-11-24(12-13)17-9-8-16(22-23-17)14-6-4-5-7-15(14)20/h4-9,13H,10-12H2,1-3H3,(H,21,25)

Composition: C (63.67%), H (6.47%), F (5.30%), N (15.63%), O (8.93%)

Molar Mass: 358.417

Atom Count: 49

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	358.18050416
Formal Charge	0
FSP3	0.42
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	GVBNEXLWCFMHCP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	98.88
Topological Polar Surface Area	67.35
Polarizability	38.04
Ring Count	3
Rotatable Bond Count	5

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90%	<2 Days	1638612-48-2		$51.35-$86.31$51.35$63.37$86.31