tetramethylglycoluril | SBID = 2119 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | |||
| Ertl TPSA/Å2: | 47.1 | ||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | -0.88 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | |||
| Number of H-Bond Acceptors: | |||
| Number of Stereogenic Bonds (E/Z): | |||
| Number of Stereogenic Atoms (R/S): | |||
| 3D Volume/Å3: | |||
| Sum Formula: | C8H14N4O2 | ||
| M / g/mol: | 198.22 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags:
- Name: tetramethylglycoluril
- Preferred Abbreviation: TMGU
- IUPAC Name: tetrahydro-1,3,4,6-tetramethylimidazo[4,5-d]imidazole-2,5(1H,3H)-dione
- CAS: 10095-06-4
- CID: -932
- InChiKey: XIUUSFJTJXFNGH-UHFFFAOYSA-N
- InChi: InChI=1S/C8H14N4O2/c1-9-5-6(11(3)7(9)13)12(4)8(14)10(5)2/h5-6H,1-4H3
- CanoSmiles: CN1C(=O)N(C2C1N(C)C(=O)N2C)C
- IsoSmiles: O=C1N(C)C2C(N(C)C(N2C)=O)N1C
