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4-chloro-2-(ethylsulfanyl)quinazoline

4-chloro-2-(ethylsulfanyl)quinazoline

CAS: 58803-78-4

Formula: C10H9ClN2S

SMILES: CCSC1=NC2=CC=CC=C2C(Cl)=N1

IUPAC: 4-chloro-2-(ethylsulfanyl)quinazoline

InChI: InChI=1S/C10H9ClN2S/c1-2-14-10-12-8-6-4-3-5-7(8)9(11)13-10/h3-6H,2H2,1H3

Composition: C (53.45%), H (4.04%), Cl (15.78%), N (12.47%), S (14.27%)

Molar Mass: 224.71

Atom Count: 23

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 224.0174972
Formal Charge 0
FSP3 0.2
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey YXMGMRFURWMKDY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.17
Topological Polar Surface Area 25.78
Polarizability 24.75
Ring Count 2
Rotatable Bond Count 2

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