6-(methylsulfanyl)-N-(pyridin-3-ylmethyl)-1,2,4,5-tetrazin-3-amine

6-(methylsulfanyl)-N-(pyridin-3-ylmethyl)-1,2,4,5-tetrazin-3-amine

CAS: 866154-08-7

Formula: C9H10N6S

SMILES: CSC1=NN=C(NCC2=CN=CC=C2)N=N1

IUPAC: 6-(methylsulfanyl)-N-[(pyridin-3-yl)methyl]-1,2,4,5-tetrazin-3-amine

InChI: InChI=1S/C9H10N6S/c1-16-9-14-12-8(13-15-9)11-6-7-3-2-4-10-5-7/h2-5H,6H2,1H3,(H,11,12,13)

Composition: C (46.14%), H (4.30%), N (35.87%), S (13.68%)

Molar Mass: 234.28

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	234.06876552
Formal Charge	0
FSP3	0.22
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	NXZWRGNUFJZWKV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.73
Topological Polar Surface Area	76.48
Polarizability	23.42
Ring Count	2
Rotatable Bond Count	4

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