6-methoxy-2-(4-methylphenyl)-1,3-benzothiazole

6-methoxy-2-(4-methylphenyl)-1,3-benzothiazole

CAS: 101078-51-7

Formula: C15H13NOS

SMILES: COC1=CC=C2N=C(SC2=C1)C1=CC=C(C)C=C1

IUPAC: 6-methoxy-2-(4-methylphenyl)-1,3-benzothiazole

InChI: InChI=1S/C15H13NOS/c1-10-3-5-11(6-4-10)15-16-13-8-7-12(17-2)9-14(13)18-15/h3-9H,1-2H3

Composition: C (70.56%), H (5.13%), N (5.49%), O (6.27%), S (12.56%)

Molar Mass: 255.34

Atom Count: 31

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	255.071785217
Formal Charge	0
FSP3	0.13
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	HYPBHVPYFUNVJM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.73
Topological Polar Surface Area	22.12
Polarizability	30.22
Ring Count	3
Rotatable Bond Count	2

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