tert-butyl 2-[4-(4-bromophenyl)-1H-imidazol-2-yl]pyrrolidine-1-carboxylate

tert-butyl 2-[4-(4-bromophenyl)-1H-imidazol-2-yl]pyrrolidine-1-carboxylate

Formula: C18H22BrN3O2

SMILES: CC(C)(C)OC(=O)N1CCCC1C1=NC(=CN1)C1=CC=C(Br)C=C1

IUPAC: tert-butyl 2-[4-(4-bromophenyl)-1H-imidazol-2-yl]pyrrolidine-1-carboxylate

InChI: InChI=1/C18H22BrN3O2/c1-18(2,3)24-17(23)22-10-4-5-15(22)16-20-11-14(21-16)12-6-8-13(19)9-7-12/h6-9,11,15H,4-5,10H2,1-3H3,(H,20,21)

Composition: C (55.11%), H (5.65%), Br (20.37%), N (10.71%), O (8.16%)

Molar Mass: 392.297

Atom Count: 46

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	391.08954
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SEJWRHUDDTVGHP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.26
Topological Polar Surface Area	58.22
Polarizability	38.54
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H22BrN3O2		Quote Only