4-chloro-6-methyl-1,3-benzothiazol-2-amine

4-chloro-6-methyl-1,3-benzothiazol-2-amine

CAS: 383131-41-7

Formula: C8H7ClN2S

SMILES: CC1=CC(Cl)=C2N=C(N)SC2=C1

IUPAC: 4-chloro-6-methyl-1,3-benzothiazol-2-amine

InChI: InChI=1S/C8H7ClN2S/c1-4-2-5(9)7-6(3-4)12-8(10)11-7/h2-3H,1H3,(H2,10,11)

Composition: C (48.37%), H (3.55%), Cl (17.84%), N (14.10%), S (16.14%)

Molar Mass: 198.67

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	198.0018471
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	UKZNGVGJUJBHEN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.15
Topological Polar Surface Area	38.91
Polarizability	20.4
Ring Count	2
Rotatable Bond Count	0

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