(5Z)-5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

(5Z)-5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Formula: C19H15BrFN3O2S

SMILES: CN(C)C1=CC=C(C=C2C(=O)NC(=S)N(C2=O)C2=CC=C(F)C=C2)C=C1Br

IUPAC: (5Z)-5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-1-(4-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

InChI: InChI=1S/C19H15BrFN3O2S/c1-23(2)16-8-3-11(10-15(16)20)9-14-17(25)22-19(27)24(18(14)26)13-6-4-12(21)5-7-13/h3-10H,1-2H3,(H,22,25,27)/b14-9-

Composition: C (50.90%), H (3.37%), Br (17.82%), F (4.24%), N (9.37%), O (7.14%), S (7.15%)

Molar Mass: 448.31

Atom Count: 42

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	447.005239
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NZCZIQLDHULBOM-ZROIWOOFSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.05
Topological Polar Surface Area	52.65
Polarizability	41.29
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H15BrFN3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00