Geometry & MOs
Info
ID: |
425819 |
PubChem CID: |
135128147 |
Reduced: |
OS2N5C14H15 (1) |
Stoich.: |
AB2C5D14E15 (1) |
Weight, g/mol: |
1473.547247 |
ΔHf, kcal/mol: |
49.65 |
Dipole, Da: |
4.32 |
IP(EA), eV: |
-8.61(-1.03) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
5-[[6-[(5R)-5-[[5-[[6-[4-[[hydroxy-[5-[[4-[(4-hydroxy-4-methylcyclohexyl)amino]thieno[3,2-d]pyrimidin-2-yl]amino]-1,2-thiazol-3-yl]methyl]amino]piperidin-1-yl]-4-[(4-hydroxy-4-methylcyclohexyl)amino]thieno[3,2-d]pyrimidin-2-yl]amino]-1,2-thiazole-3-carbonyl]amino]piperidin-2-yl]-4-[(4-hydroxy-4-methylcyclohexyl)amino]thieno[3,2-d]pyrimidin-2-yl]amino]-N-(piperidin-4-ylmethyl)-1,2-thiazole-3-carboxamide