N-(4-ethoxyphenyl)-2-(4-methylphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-(4-methylphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
N-(4-ethoxyphenyl)-2-(4-methylphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Compound characteristics
| Compound ID: | E972-0098 |
| Compound Name: | N-(4-ethoxyphenyl)-2-(4-methylphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide |
| Molecular Weight: | 436.58 |
| Molecular Formula: | C24 H28 N4 O2 S |
| Smiles: | CCOc1ccc(cc1)NC(N1CCC2(CC1)N=C(C(=N2)SC)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1133 |
| logD: | 4.1133 |
| logSw: | -3.9412 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.753 |
| InChI Key: | CXYXCFYBCBMGOS-UHFFFAOYSA-N |