7-[(4-methylphenyl)methyl]-2,5,7-triazatricyclo[6.4.0.0²,?]dodeca-1(8),5,9,11-tetraene

7-[(4-methylphenyl)methyl]-2,5,7-triazatricyclo[6.4.0.0²,?]dodeca-1(8),5,9,11-tetraene

Formula: C17H17N3

SMILES: CC1=CC=C(CN2C3=NCCN3C3=C2C=CC=C3)C=C1

IUPAC: 7-[(4-methylphenyl)methyl]-2,5,7-triazatricyclo[6.4.0.0²,?]dodeca-1(8),5,9,11-tetraene

InChI: InChI=1S/C17H17N3/c1-13-6-8-14(9-7-13)12-20-16-5-3-2-4-15(16)19-11-10-18-17(19)20/h2-9H,10-12H2,1H3

Composition: C (77.54%), H (6.51%), N (15.96%)

Molar Mass: 263.344

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	263.142247559
Formal Charge	0
FSP3	0.24
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	SIXHSLJCOHWHSM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.1
Topological Polar Surface Area	18.84
Polarizability	30.61
Ring Count	4
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H17N3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00