methyl 2-amino-5-ethyl-1,3-thiazole-4-carboxylate

methyl 2-amino-5-ethyl-1,3-thiazole-4-carboxylate

CAS: 28942-54-3

Formula: C7H10N2O2S

SMILES: CCC1=C(N=C(N)S1)C(=O)OC

IUPAC: methyl 2-amino-5-ethyl-1,3-thiazole-4-carboxylate

InChI: InChI=1S/C7H10N2O2S/c1-3-4-5(6(10)11-2)9-7(8)12-4/h3H2,1-2H3,(H2,8,9)

Composition: C (45.15%), H (5.41%), N (15.04%), O (17.18%), S (17.22%)

Molar Mass: 186.23

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	186.046298744
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	GIAXMSUPTGGVFG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.67
Topological Polar Surface Area	65.21
Polarizability	17.38
Ring Count	1
Rotatable Bond Count	3

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