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2-methoxy-10H-phenothiazine

2-methoxy-10H-phenothiazine

CAS: 1771-18-2

Formula: C13H11NOS

SMILES: COC1=CC2=C(SC3=CC=CC=C3N2)C=C1

IUPAC: 2-methoxy-10H-phenothiazine

InChI: InChI=1S/C13H11NOS/c1-15-9-6-7-13-11(8-9)14-10-4-2-3-5-12(10)16-13/h2-8,14H,1H3

Composition: C (68.10%), H (4.84%), N (6.11%), O (6.98%), S (13.98%)

Molar Mass: 229.3

Atom Count: 27

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 229.056135152
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DLYKFPHPBCTAKD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.63
Topological Polar Surface Area 21.26
Polarizability 25.89
Ring Count 3
Rotatable Bond Count 1

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