5,6-dimethyl-2-(morpholin-4-ylsulfanyl)-1H-1,3-benzodiazole

5,6-dimethyl-2-(morpholin-4-ylsulfanyl)-1H-1,3-benzodiazole

Formula: C13H17N3OS

SMILES: CC1=C(C)C=C2N=C(NC2=C1)SN1CCOCC1

IUPAC: 5,6-dimethyl-2-(morpholin-4-ylsulfanyl)-1H-1,3-benzodiazole

InChI: InChI=1S/C13H17N3OS/c1-9-7-11-12(8-10(9)2)15-13(14-11)18-16-3-5-17-6-4-16/h7-8H,3-6H2,1-2H3,(H,14,15)

Composition: C (59.29%), H (6.51%), N (15.96%), O (6.07%), S (12.17%)

Molar Mass: 263.36

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	263.109233353
Formal Charge	0
FSP3	0.46
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WZTKWLMCDMYTEA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.66
Topological Polar Surface Area	41.15
Polarizability	30.08
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H17N3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00