2,4-diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine

2,4-diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine

CAS: 1269508-31-7

Formula: C27H26BN3O2

SMILES: CC1(C)OB(OC1(C)C)C1=CC=CC(=C1)C1=NC(=NC(=N1)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 2,4-diphenyl-6-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,5-triazine

InChI: InChI=1S/C27H26BN3O2/c1-26(2)27(3,4)33-28(32-26)22-17-11-16-21(18-22)25-30-23(19-12-7-5-8-13-19)29-24(31-25)20-14-9-6-10-15-20/h5-18H,1-4H3

Composition: C (74.49%), H (6.02%), B (2.48%), N (9.65%), O (7.35%)

Molar Mass: 435.33

Atom Count: 59

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	435.211807
Formal Charge	0
FSP3	0.22
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	FXHGBACNYDFALU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	158.41
Topological Polar Surface Area	57.13
Polarizability	52.26
Ring Count	5
Rotatable Bond Count	4

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