5-benzoyl-10-[4-(diethylamino)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

5-benzoyl-10-[4-(diethylamino)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

Formula: C30H31N3O2

SMILES: CCN(CC)C1=CC=C(C=C1)C1NC2=CC=C(C=C2NC2=C1C(=O)CCC2)C(=O)C1=CC=CC=C1

IUPAC: 5-benzoyl-10-[4-(diethylamino)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3,5,7-tetraen-12-one

InChI: InChI=1/C30H31N3O2/c1-3-33(4-2)23-16-13-20(14-17-23)29-28-25(11-8-12-27(28)34)31-26-19-22(15-18-24(26)32-29)30(35)21-9-6-5-7-10-21/h5-7,9-10,13-19,29,31-32H,3-4,8,11-12H2,1-2H3

Composition: C (77.39%), H (6.71%), N (9.03%), O (6.87%)

Molar Mass: 465.597

Atom Count: 66

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	465.24162725
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	ARCLZXQISKCVPB-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	146.23
Topological Polar Surface Area	61.44
Polarizability	53.64
Ring Count	5
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C30H31N3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00