2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-N-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-N-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-N-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Compound characteristics
| Compound ID: | E972-0012 |
| Compound Name: | 2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-N-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide |
| Molecular Weight: | 448.63 |
| Molecular Formula: | C26 H32 N4 O S |
| Smiles: | CCSC1C(c2ccc(cc2)C(C)(C)C)=NC2(CCN(CC2)C(Nc2ccccc2)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 5.3604 |
| logD: | 5.3604 |
| logSw: | -5.2643 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.63 |
| InChI Key: | RGBQNGPHOABNDK-UHFFFAOYSA-N |