1-benzoyl-3-(1H-1,3-benzodiazol-5-yl)thiourea

1-benzoyl-3-(1H-1,3-benzodiazol-5-yl)thiourea

CAS: 861208-79-9

Formula: C15H12N4OS

SMILES: O=C(NC(=S)NC1=CC=C2NC=NC2=C1)C1=CC=CC=C1

IUPAC: 1-benzoyl-3-(1H-1,3-benzodiazol-5-yl)thiourea

InChI: InChI=1S/C15H12N4OS/c20-14(10-4-2-1-3-5-10)19-15(21)18-11-6-7-12-13(8-11)17-9-16-12/h1-9H,(H,16,17)(H2,18,19,20,21)

Composition: C (60.80%), H (4.08%), N (18.91%), O (5.40%), S (10.82%)

Molar Mass: 296.35

Atom Count: 33

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	296.073182196
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
InChIKey	OVJFWSWCPYXZPX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	86.74
Topological Polar Surface Area	69.81
Polarizability	33.51
Ring Count	3
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	861208-79-9		$51.35-$524.40$51.35$63.37$86.31$524.40