3-(2-bromobenzoyl)-1-(2-fluoro-5-nitrophenyl)thiourea

3-(2-bromobenzoyl)-1-(2-fluoro-5-nitrophenyl)thiourea

Formula: C14H9BrFN3O3S

SMILES: [O-][N+](=O)C1=CC=C(F)C(NC(=S)NC(=O)C2=CC=CC=C2Br)=C1

IUPAC: 3-(2-bromobenzoyl)-1-(2-fluoro-5-nitrophenyl)thiourea

InChI: InChI=1S/C14H9BrFN3O3S/c15-10-4-2-1-3-9(10)13(20)18-14(23)17-12-7-8(19(21)22)5-6-11(12)16/h1-7H,(H2,17,18,20,23)

Composition: C (42.23%), H (2.28%), Br (20.07%), F (4.77%), N (10.55%), O (12.05%), S (8.05%)

Molar Mass: 398.21

Atom Count: 32

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	396.953203
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	UNEOFBQYXQKFEC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.98
Topological Polar Surface Area	84.27
Polarizability	33.67
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H9BrFN3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00