2-{[3-(4-tert-butylphenyl)-8-ethyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-{[3-(4-tert-butylphenyl)-8-ethyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
2-{[3-(4-tert-butylphenyl)-8-ethyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | F288-0042 |
| Compound Name: | 2-{[3-(4-tert-butylphenyl)-8-ethyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 490.71 |
| Molecular Formula: | C29 H38 N4 O S |
| Smiles: | CCc1ccc(cc1)NC(CSC1C(c2ccc(cc2)C(C)(C)C)=NC2(CCN(CC)CC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1964 |
| logD: | 3.5541 |
| logSw: | -5.4279 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.767 |
| InChI Key: | MYTJKVJTZRTQLK-UHFFFAOYSA-N |