4-[(4-chlorophenoxy)methyl]-11,12-diphenyl-10-oxa-3,5,6,8-tetraazatricyclo[7.3.0.0²,?]dodeca-1(9),2,4,7,11-pentaene

4-[(4-chlorophenoxy)methyl]-11,12-diphenyl-10-oxa-3,5,6,8-tetraazatricyclo[7.3.0.0²,?]dodeca-1(9),2,4,7,11-pentaene

Formula: C26H17ClN4O2

SMILES: ClC1=CC=C(OCC2=NN3C=NC4=C(C3=N2)C(=C(O4)C2=CC=CC=C2)C2=CC=CC=C2)C=C1

IUPAC: 4-[(4-chlorophenoxy)methyl]-11,12-diphenyl-10-oxa-3,5,6,8-tetraazatricyclo[7.3.0.0²,?]dodeca-1(9),2,4,7,11-pentaene

InChI: InChI=1S/C26H17ClN4O2/c27-19-11-13-20(14-12-19)32-15-21-29-25-23-22(17-7-3-1-4-8-17)24(18-9-5-2-6-10-18)33-26(23)28-16-31(25)30-21/h1-14,16H,15H2

Composition: C (68.95%), H (3.78%), Cl (7.83%), N (12.37%), O (7.07%)

Molar Mass: 452.9

Atom Count: 50

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	6
Asymmetric Atom Count	0
Exact Mass	452.1040035
Formal Charge	0
FSP3	0.04
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	SWWICUKWBVMEQB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	137.28
Topological Polar Surface Area	65.45
Polarizability	51.14
Ring Count	6
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H17ClN4O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00