N-methyl-6-[(methylsulfanyl)methyl]-N,2-diphenylpyrimidin-4-amine

N-methyl-6-[(methylsulfanyl)methyl]-N,2-diphenylpyrimidin-4-amine

CAS: 478031-64-0

Formula: C19H19N3S

SMILES: CSCC1=NC(=NC(=C1)N(C)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: N-methyl-6-[(methylsulfanyl)methyl]-N,2-diphenylpyrimidin-4-amine

InChI: InChI=1S/C19H19N3S/c1-22(17-11-7-4-8-12-17)18-13-16(14-23-2)20-19(21-18)15-9-5-3-6-10-15/h3-13H,14H2,1-2H3

Composition: C (71.00%), H (5.96%), N (13.07%), S (9.97%)

Molar Mass: 321.44

Atom Count: 42

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	321.129968798
Formal Charge	0
FSP3	0.16
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	FKTJANUKUFNCOX-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	108.9
Topological Polar Surface Area	29.02
Polarizability	38.19
Ring Count	3
Rotatable Bond Count	5

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