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2-(1H-1,3-benzodiazol-2-ylsulfanyl)-N-(1,3-thiazol-2-yl)propanamide

2-(1H-1,3-benzodiazol-2-ylsulfanyl)-N-(1,3-thiazol-2-yl)propanamide

Formula: C13H12N4OS2

SMILES: CC(SC1=NC2=CC=CC=C2N1)C(=O)NC1=NC=CS1

IUPAC: 2-(1H-1,3-benzodiazol-2-ylsulfanyl)-N-(1,3-thiazol-2-yl)propanamide

InChI: InChI=1/C13H12N4OS2/c1-8(11(18)17-12-14-6-7-19-12)20-13-15-9-4-2-3-5-10(9)16-13/h2-8H,1H3,(H,15,16)(H,14,17,18)

Composition: C (51.30%), H (3.97%), N (18.41%), O (5.26%), S (21.07%)

Molar Mass: 304.39

Atom Count: 32

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 304.04525337
Formal Charge 0
FSP3 0.15
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey KTEBCRSXUKVTAQ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 80.89
Topological Polar Surface Area 70.67
Polarizability 31.82
Ring Count 3
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H12N4OS2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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