[(3-chloro-1-benzothiophen-2-yl)methylidene][(4-methylphenyl)methoxy]amine

[(3-chloro-1-benzothiophen-2-yl)methylidene][(4-methylphenyl)methoxy]amine

CAS: 477859-26-0

Formula: C17H14ClNOS

SMILES: CC1=CC=C(CON=CC2=C(Cl)C3=CC=CC=C3S2)C=C1

IUPAC: [(3-chloro-1-benzothiophen-2-yl)methylidene][(4-methylphenyl)methoxy]amine

InChI: InChI=1S/C17H14ClNOS/c1-12-6-8-13(9-7-12)11-20-19-10-16-17(18)14-4-2-3-5-15(14)21-16/h2-10H,11H2,1H3

Composition: C (64.65%), H (4.47%), Cl (11.22%), N (4.44%), O (5.07%), S (10.15%)

Molar Mass: 315.82

Atom Count: 35

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	315.0484629
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KFNVAWZCYPILMA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	88.53
Topological Polar Surface Area	21.59
Polarizability	34.85
Ring Count	3
Rotatable Bond Count	4

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