5-(4-methoxyphenoxymethyl)-1,3,4-thiadiazol-2-amine

5-(4-methoxyphenoxymethyl)-1,3,4-thiadiazol-2-amine

CAS: 364360-13-4

Formula: C10H11N3O2S

SMILES: COC1=CC=C(OCC2=NN=C(N)S2)C=C1

IUPAC: 5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-amine

InChI: InChI=1S/C10H11N3O2S/c1-14-7-2-4-8(5-3-7)15-6-9-12-13-10(11)16-9/h2-5H,6H2,1H3,(H2,11,13)

Composition: C (50.62%), H (4.67%), N (17.71%), O (13.49%), S (13.51%)

Molar Mass: 237.28

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	237.05719778
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	BVYNFLPAMUDFSH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.43
Topological Polar Surface Area	70.26
Polarizability	23.07
Ring Count	2
Rotatable Bond Count	4

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