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2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

Formula: C11H10N4OS

SMILES: NC(=O)CSC1=NC=C(N=N1)C1=CC=CC=C1

IUPAC: 2-[(6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide

InChI: InChI=1S/C11H10N4OS/c12-10(16)7-17-11-13-6-9(14-15-11)8-4-2-1-3-5-8/h1-6H,7H2,(H2,12,16)

Composition: C (53.64%), H (4.09%), N (22.75%), O (6.50%), S (13.02%)

Molar Mass: 246.29

Atom Count: 27

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 246.057532132
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QGLLYRFGYVXOET-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.11
Topological Polar Surface Area 81.76
Polarizability 26.58
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H10N4OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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