2-(3,4-dichlorophenyl)-5,7-dimethyl-5,7,9-triazatetracyclo[8.7.0.0³,?.0¹¹,¹?]heptadeca-3(8),9,11(16),12,14-pentaene-4,6,17-trione

2-(3,4-dichlorophenyl)-5,7-dimethyl-5,7,9-triazatetracyclo[8.7.0.0³,?.0¹¹,¹?]heptadeca-3(8),9,11(16),12,14-pentaene-4,6,17-trione

Formula: C22H15Cl2N3O3

SMILES: CN1C(=O)N(C)C2=C(C(C3C(=O)C4=C(C=CC=C4)C3=N2)C2=CC=C(Cl)C(Cl)=C2)C1=O

IUPAC: 2-(3,4-dichlorophenyl)-5,7-dimethyl-5,7,9-triazatetracyclo[8.7.0.0³,?.0¹¹,¹?]heptadeca-3(8),9,11(16),12,14-pentaene-4,6,17-trione

InChI: InChI=1/C22H15Cl2N3O3/c1-26-20-17(21(29)27(2)22(26)30)15(10-7-8-13(23)14(24)9-10)16-18(25-20)11-5-3-4-6-12(11)19(16)28/h3-9,15-16H,1-2H3

Composition: C (60.02%), H (3.43%), Cl (16.10%), N (9.54%), O (10.90%)

Molar Mass: 440.28

Atom Count: 45

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	2
Exact Mass	439.0490468
Formal Charge	0
FSP3	0.18
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	HSQSMCGSQOTHQE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	123.08
Topological Polar Surface Area	70.05
Polarizability	42.93
Ring Count	5
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H15Cl2N3O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00