tri-tert-butyl 2,2',2''-(1,3,5-triazinane-2,4,6-triylidene)tris(3-oxobutanoate)
Chemical Structure Depiction of
tri-tert-butyl 2,2',2''-(1,3,5-triazinane-2,4,6-triylidene)tris(3-oxobutanoate)
tri-tert-butyl 2,2',2''-(1,3,5-triazinane-2,4,6-triylidene)tris(3-oxobutanoate)
Compound characteristics
| Compound ID: | 8008-7817 |
| Compound Name: | tri-tert-butyl 2,2',2''-(1,3,5-triazinane-2,4,6-triylidene)tris(3-oxobutanoate) |
| Molecular Weight: | 549.62 |
| Molecular Formula: | C27 H39 N3 O9 |
| Smiles: | CC(C(=C1NC(=C(C(C)=O)C(=O)OC(C)(C)C)NC(=C(C(C)=O)C(=O)OC(C)(C)C)N1)C(=O)OC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2726 |
| logD: | -7.879 |
| logSw: | -3.3435 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 133.289 |
| InChI Key: | DKDZOIGTTFKJDO-UHFFFAOYSA-N |