5-benzoyl-10-[4-(dimethylamino)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

5-benzoyl-10-[4-(dimethylamino)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

Formula: C28H27N3O2

SMILES: CN(C)C1=CC=C(C=C1)C1NC2=C(NC3=C1C(=O)CCC3)C=C(C=C2)C(=O)C1=CC=CC=C1

IUPAC: 5-benzoyl-10-[4-(dimethylamino)phenyl]-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

InChI: InChI=1/C28H27N3O2/c1-31(2)21-14-11-18(12-15-21)27-26-23(9-6-10-25(26)32)29-24-17-20(13-16-22(24)30-27)28(33)19-7-4-3-5-8-19/h3-5,7-8,11-17,27,29-30H,6,9-10H2,1-2H3

Composition: C (76.86%), H (6.22%), N (9.60%), O (7.31%)

Molar Mass: 437.543

Atom Count: 60

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	437.210327121
Formal Charge	0
FSP3	0.21
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	GDAYKPCAGLNMJO-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	136.73
Topological Polar Surface Area	61.44
Polarizability	49.95
Ring Count	5
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H27N3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00