10-[3-(benzyloxy)-4-methoxyphenyl]-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

10-[3-(benzyloxy)-4-methoxyphenyl]-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

Formula: C29H30N2O3

SMILES: COC1=CC=C(C=C1OCC1=CC=CC=C1)C1NC2=CC=CC=C2NC2=C1C(=O)CC(C)(C)C2

IUPAC: 10-[3-(benzyloxy)-4-methoxyphenyl]-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

InChI: InChI=1/C29H30N2O3/c1-29(2)16-23-27(24(32)17-29)28(31-22-12-8-7-11-21(22)30-23)20-13-14-25(33-3)26(15-20)34-18-19-9-5-4-6-10-19/h4-15,28,30-31H,16-18H2,1-3H3

Composition: C (76.63%), H (6.65%), N (6.16%), O (10.56%)

Molar Mass: 454.57

Atom Count: 64

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	454.225642834
Formal Charge	0
FSP3	0.28
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	LLCZEDBPVPRULD-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	138.29
Topological Polar Surface Area	59.59
Polarizability	51.78
Ring Count	5
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H30N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00