(5Z)-1-(4-bromophenyl)-5-({3-chloro-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione

(5Z)-1-(4-bromophenyl)-5-({3-chloro-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione

Formula: C27H22BrClN2O6

SMILES: COC1=CC(C=C2C(=O)NC(=O)N(C2=O)C2=CC=C(Br)C=C2)=CC(Cl)=C1OCCOC1=CC=C(C)C=C1

IUPAC: (5Z)-1-(4-bromophenyl)-5-({3-chloro-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C27H22BrClN2O6/c1-16-3-9-20(10-4-16)36-11-12-37-24-22(29)14-17(15-23(24)35-2)13-21-25(32)30-27(34)31(26(21)33)19-7-5-18(28)6-8-19/h3-10,13-15H,11-12H2,1-2H3,(H,30,32,34)/b21-13-

Composition: C (55.36%), H (3.79%), Br (13.64%), Cl (6.05%), N (4.78%), O (16.39%)

Molar Mass: 585.84

Atom Count: 59

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	584.034977
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	ADMYVNZYCMXOML-BKUYFWCQSA-N
Lipinski's Rule of Five
Molar Refractivity	141.74
Topological Polar Surface Area	94.17
Polarizability	54.3
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H22BrClN2O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00