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

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

Formula: C13H13N3O2S

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

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

InChI: InChI=1S/C13H13N3O2S/c1-2-18-12(17)9-19-13-14-8-11(15-16-13)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3

Composition: C (56.71%), H (4.76%), N (15.26%), O (11.62%), S (11.64%)

Molar Mass: 275.33

Atom Count: 32

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	275.072847845
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	ZQGAPNGSFYRCMF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.8
Topological Polar Surface Area	64.97
Polarizability	29.82
Ring Count	2
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H13N3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00