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2-(4-bromophenyl)-2,3-dihydro-1H-perimidine

2-(4-bromophenyl)-2,3-dihydro-1H-perimidine

CAS: 64369-13-7

Formula: C17H13BrN2

SMILES: BrC1=CC=C(C=C1)C1NC2=CC=CC3=CC=CC(N1)=C23

IUPAC: 2-(4-bromophenyl)-2,3-dihydro-1H-perimidine

InChI: InChI=1S/C17H13BrN2/c18-13-9-7-12(8-10-13)17-19-14-5-1-3-11-4-2-6-15(20-17)16(11)14/h1-10,17,19-20H

Composition: C (62.79%), H (4.03%), Br (24.57%), N (8.61%)

Molar Mass: 325.209

Atom Count: 33

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 324.026211
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey YSRRRCGJBGQBDM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 87.9
Topological Polar Surface Area 24.06
Polarizability 33.45
Ring Count 4
Rotatable Bond Count 1

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