Molecule ID: 1598

IUPAC Name: 2-diphenylboranyloxyethanamine

Description: The molecule is an organoboron compound that is diphenylborane in which the borane hydrogen is replaced by a 2-aminoethoxy group. It has a role as an IP3 receptor antagonist, a calcium channel blocker and a potassium channel opener. It is an organoboron compound and a primary amino compound.

SMILES: NCCOB(c1ccccc1)c1ccccc1

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

InChI: InChI=1S/C14H16BNO/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12,16H2

Molecular Properties:
- Polar Surface Area: 35.2 Ų
- LogP: nan