5-{[4-(2-bromoethoxy)-3-methoxyphenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione

5-{[4-(2-bromoethoxy)-3-methoxyphenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Formula: C16H17BrN2O5

SMILES: COC1=CC(C=C2C(=O)N(C)C(=O)N(C)C2=O)=CC=C1OCCBr

IUPAC: 5-{[4-(2-bromoethoxy)-3-methoxyphenyl]methylidene}-1,3-dimethyl-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C16H17BrN2O5/c1-18-14(20)11(15(21)19(2)16(18)22)8-10-4-5-12(24-7-6-17)13(9-10)23-3/h4-5,8-9H,6-7H2,1-3H3

Composition: C (48.38%), H (4.31%), Br (20.12%), N (7.05%), O (20.14%)

Molar Mass: 397.225

Atom Count: 41

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	396.032085
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	UZEMJKLNYFUDBN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.17
Topological Polar Surface Area	76.15
Polarizability	34.5
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H17BrN2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00