Molecule ID: 119058160

IUPAC Name: (10aS)-10,10a-dihydrophenazine-1-carboxylic acid

Description: The molecule is a member of the class of phenazines that is (10aS)-10,10a-dihydrophenazine substituted at position 1 by a carboxy group It is a member of phenazines and an aromatic amino acid. It is a conjugate acid of a (10aS)-10,10a-dihydrophenazine-1-carboxylate.

SMILES: O=C(O)C1=CC=CC2=Nc3ccccc3N[C@@H]12

SELFIES: [O][=C][Branch1][C][O][C][=C][C][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C@@H1][Ring1][=C][Ring1][#Branch2]

InChI: InChI=1S/C13H10N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7,12,15H,(H,16,17)/t12-/m0/s1

Molecular Properties:
- Polar Surface Area: 61.7 Ų
- LogP: 1.8