3-[benzyl(2-hydroxyethyl)amino]-1??,2-benzothiazole-1,1-dione

3-[benzyl(2-hydroxyethyl)amino]-1??,2-benzothiazole-1,1-dione

Formula: C16H16N2O3S

SMILES: OCCN(CC1=CC=CC=C1)C1=NS(=O)(=O)C2=C1C=CC=C2

IUPAC: 3-[benzyl(2-hydroxyethyl)amino]-1??,2-benzothiazole-1,1-dione

InChI: InChI=1S/C16H16N2O3S/c19-11-10-18(12-13-6-2-1-3-7-13)16-14-8-4-5-9-15(14)22(20,21)17-16/h1-9,19H,10-12H2

Composition: C (60.74%), H (5.10%), N (8.85%), O (15.17%), S (10.13%)

Molar Mass: 316.38

Atom Count: 38

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	316.088163557
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	MUAVDUDIVROKKP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.35
Topological Polar Surface Area	69.97
Polarizability	33.16
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H16N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00