Molecule ID: 16526

IUPAC Name: 2-amino-4,5-dihydro-1,3-thiazole-4-carboxylic acid

Description: The molecule is a 1,3-thiazole that is 4,5-dihydro-1,3-thiazole which is substituted at positions 2 and 4 by an amino and a carboxy group, respectively. It is a member of 1,3-thiazoles and a sulfur-containing amino acid. It is a tautomer of a 2-amino-Delta(2)-thiazoline-4-carboxylic acid zwitterion.

SMILES: N=C1NC(C(=O)O)CS1

SELFIES: [N][=C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][S][Ring1][Branch2]

InChI: InChI=1S/C4H6N2O2S/c5-4-6-2(1-9-4)3(7)8/h2H,1H2,(H2,5,6)(H,7,8)

Molecular Properties:
- Polar Surface Area: 101.0 Ų
- LogP: -0.4