(7-chloroquinolin-4-yl)aminothiourea

(7-chloroquinolin-4-yl)aminothiourea

CAS: 93439-33-9

Formula: C10H9ClN4S

SMILES: NC(=S)NNC1=C2C=CC(Cl)=CC2=NC=C1

IUPAC: [(7-chloroquinolin-4-yl)amino]thiourea

InChI: InChI=1S/C10H9ClN4S/c11-6-1-2-7-8(14-15-10(12)16)3-4-13-9(7)5-6/h1-5H,(H,13,14)(H3,12,15,16)

Composition: C (47.53%), H (3.59%), Cl (14.03%), N (22.17%), S (12.69%)

Molar Mass: 252.72

Atom Count: 25

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	252.0236452
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	FDSPPNCQOODQKD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	69.54
Topological Polar Surface Area	62.97
Polarizability	27.51
Ring Count	2
Rotatable Bond Count	2

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90%	<2 Days	93439-33-9		$51.35-$524.40$51.35$63.37$86.31$524.40