Nom: 2-[3-(2,1,3-benzothiadiazol-5-ylmethyl)-2-oxoimidazolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylic acid

SMILES: CC1=C(SC(=N1)N2CCN(C2=O)CC3=CC4=NSN=C4C=C3)C(=O)O

Molecular Processing

Molecular formula

C15H13N5O3S2

Molecular weight

375.44

Exact mass

375.046

XLogP

2.6

TPSA

99.52

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.267

Molar refractivity

94.38

Supplementary Information

InChIKey: HBOUVLBSLGLRDF-UHFFFAOYSA-N

Synonymes

SCHEMBL242163HBOUVLBSLGLRDF-UHFFFAOYSA-N2-(3-(benzo[c][1,2,5]thiadiazol-5-ylmethyl)-2-oxoimidazolidin-1-yl)-4-methylthiazole-5-carboxylic acid