Geometry & MOs
Info
ID: |
434911 |
PubChem CID: |
135175971 |
Reduced: |
N2C13H18 (1) |
Stoich.: |
A2B13C18 (1) |
Weight, g/mol: |
1049.599698 |
ΔHf, kcal/mol: |
17.45 |
Dipole, Da: |
1.23 |
IP(EA), eV: |
-8.26(0.03) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S,4R)-1-[(2S)-3,3-dimethyl-2-[[2-[3-[4-[3-[[6-[[2-(4-methylpiperidin-1-yl)pyrimidin-4-yl]amino]-1-propan-2-ylimidazo[4,5-c]pyridin-2-yl]methoxy]propyl]piperazin-1-yl]propoxy]acetyl]amino]butanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide