4-amino-N-(2-{[(4-bromothiophen-2-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide

4-amino-N-(2-{[(4-bromothiophen-2-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide

Formula: C10H12BrN5O2S

SMILES: NC1=NON=C1C(=O)NCCNCC1=CC(Br)=CS1

IUPAC: 4-amino-N-(2-{[(4-bromothiophen-2-yl)methyl]amino}ethyl)-1,2,5-oxadiazole-3-carboxamide

InChI: InChI=1S/C10H12BrN5O2S/c11-6-3-7(19-5-6)4-13-1-2-14-10(17)8-9(12)16-18-15-8/h3,5,13H,1-2,4H2,(H2,12,16)(H,14,17)

Composition: C (34.69%), H (3.49%), Br (23.08%), N (20.23%), O (9.24%), S (9.26%)

Molar Mass: 346.2

Atom Count: 31

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	344.989509
Formal Charge	0
FSP3	0.3
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	DHGMUCKMDIBXPK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.9
Topological Polar Surface Area	106.07
Polarizability	27.87
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C10H12BrN5O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00