2-(2-{1-[(1E)-2-(4-bromophenyl)diazen-1-yl]butyl}diazen-1-yl)-1,3-benzothiazole

2-(2-{1-[(1E)-2-(4-bromophenyl)diazen-1-yl]butyl}diazen-1-yl)-1,3-benzothiazole

Formula: C17H16BrN5S

SMILES: CCCC(N=NC1=NC2=CC=CC=C2S1)N=NC1=CC=C(Br)C=C1

IUPAC: 2-(2-{1-[(1E)-2-(4-bromophenyl)diazen-1-yl]butyl}diazen-1-yl)-1,3-benzothiazole

InChI: InChI=1/C17H16BrN5S/c1-2-5-16(21-20-13-10-8-12(18)9-11-13)22-23-17-19-14-6-3-4-7-15(14)24-17/h3-4,6-11,16H,2,5H2,1H3/b21-20+,23-22?

Composition: C (50.75%), H (4.01%), Br (19.86%), N (17.41%), S (7.97%)

Molar Mass: 402.31

Atom Count: 40

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	401.03098
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	CJJNWQMJNVREEC-YANYVAKANA-N
Lipinski's Rule of Five
Molar Refractivity	102.09
Topological Polar Surface Area	62.33
Polarizability	38.67
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H16BrN5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00