ethyl 4-{[2-(4-tert-butylphenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[2-(4-tert-butylphenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carbonyl]amino}benzoate
ethyl 4-{[2-(4-tert-butylphenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E697-0543 |
| Compound Name: | ethyl 4-{[2-(4-tert-butylphenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carbonyl]amino}benzoate |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C27 H32 N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCC2(CC1)NC(C(c1ccc(cc1)C(C)(C)C)=N2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6652 |
| logD: | 4.6604 |
| logSw: | -4.1921 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.812 |
| InChI Key: | MJQAWDXIDHRQLR-UHFFFAOYSA-N |