5-[(5-bromothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

5-[(5-bromothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

Formula: C9H5BrN2O3S

SMILES: BrC1=CC=C(S1)C=C1C(=O)NC(=O)NC1=O

IUPAC: 5-[(5-bromothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C9H5BrN2O3S/c10-6-2-1-4(16-6)3-5-7(13)11-9(15)12-8(5)14/h1-3H,(H2,11,12,13,14,15)

Composition: C (35.90%), H (1.67%), Br (26.54%), N (9.30%), O (15.94%), S (10.65%)

Molar Mass: 301.11

Atom Count: 21

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	299.920426
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	KPDLPSZANDQPMX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.79
Topological Polar Surface Area	75.27
Polarizability	22.94
Ring Count	2
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C9H5BrN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00