2-[2-({5-methoxy-2-[3-(4-methylphenoxy)propoxy]phenyl}methyl)diazen-1-yl]-1,3-benzothiazole

2-[2-({5-methoxy-2-[3-(4-methylphenoxy)propoxy]phenyl}methyl)diazen-1-yl]-1,3-benzothiazole

Formula: C25H25N3O3S

SMILES: COC1=CC=C(OCCCOC2=CC=C(C)C=C2)C(CN=NC2=NC3=CC=CC=C3S2)=C1

IUPAC: 2-[2-({5-methoxy-2-[3-(4-methylphenoxy)propoxy]phenyl}methyl)diazen-1-yl]-1,3-benzothiazole

InChI: InChI=1S/C25H25N3O3S/c1-18-8-10-20(11-9-18)30-14-5-15-31-23-13-12-21(29-2)16-19(23)17-26-28-25-27-22-6-3-4-7-24(22)32-25/h3-4,6-13,16H,5,14-15,17H2,1-2H3

Composition: C (67.09%), H (5.63%), N (9.39%), O (10.72%), S (7.16%)

Molar Mass: 447.55

Atom Count: 57

Heavy Atom Count: 32

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	447.161662851
Formal Charge	0
FSP3	0.24
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	OZOOZHAMFJRSCD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	127.13
Topological Polar Surface Area	65.3
Polarizability	49.51
Ring Count	4
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H25N3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00