2-{[3-(3,5-dimethoxyphenyl)-1,4-diazaspiro[4.6]undeca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[3-(3,5-dimethoxyphenyl)-1,4-diazaspiro[4.6]undeca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide
2-{[3-(3,5-dimethoxyphenyl)-1,4-diazaspiro[4.6]undeca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | C250-0332 |
| Compound Name: | 2-{[3-(3,5-dimethoxyphenyl)-1,4-diazaspiro[4.6]undeca-1,3-dien-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C25 H29 N3 O3 S |
| Smiles: | COc1cc(cc(c1)OC)C1C(=NC2(CCCCCC2)N=1)SCC(Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8629 |
| logD: | 4.8629 |
| logSw: | -4.5054 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.649 |
| InChI Key: | GUBUVQCFOGRPSR-UHFFFAOYSA-N |