2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Compound characteristics
| Compound ID: | E972-0075 |
| Compound Name: | 2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-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: | Cc1ccc(cc1C)C1C(=NC2(CCN(CC2)C(Nc2cccc(c2)OC)=O)N=1)SC |
| Stereo: | ACHIRAL |
| logP: | 4.5202 |
| logD: | 4.5202 |
| logSw: | -4.2314 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.173 |
| InChI Key: | WUPOIWRUPSXALF-UHFFFAOYSA-N |