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2-methyl-5-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]pyrimidin-4-amine dihydrochloride

2-methyl-5-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]pyrimidin-4-amine dihydrochloride

CAS: 189744-94-3

Formula: C17H22Cl2N4

SMILES: Cl[H].Cl[H].CC1=NC=C(CN2CCC(=CC2)C2=CC=CC=C2)C(N)=N1

IUPAC: 2-methyl-5-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)methyl]pyrimidin-4-amine dihydrochloride

InChI: InChI=1S/C17H20N4.2ClH/c1-13-19-11-16(17(18)20-13)12-21-9-7-15(8-10-21)14-5-3-2-4-6-14;;/h2-7,11H,8-10,12H2,1H3,(H2,18,19,20);2*1H

Composition: C (57.80%), H (6.28%), Cl (20.07%), N (15.86%)

Molar Mass: 353.29

Atom Count: 45

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 352.1221521
Formal Charge 0
FSP3 0.29
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey UZHMRJRDYCRKIZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.38
Topological Polar Surface Area 55.04
Polarizability 32.65
Ring Count 3
Rotatable Bond Count 3

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