ethyl [8-(2-methylbutan-2-yl)-3-sulfanylidene-1,2,4-triazaspiro[4.5]decan-2-yl]acetate
Chemical Structure Depiction of
ethyl [8-(2-methylbutan-2-yl)-3-sulfanylidene-1,2,4-triazaspiro[4.5]decan-2-yl]acetate
ethyl [8-(2-methylbutan-2-yl)-3-sulfanylidene-1,2,4-triazaspiro[4.5]decan-2-yl]acetate
Compound characteristics
| Compound ID: | 8011-6324 |
| Compound Name: | ethyl [8-(2-methylbutan-2-yl)-3-sulfanylidene-1,2,4-triazaspiro[4.5]decan-2-yl]acetate |
| Molecular Weight: | 327.49 |
| Molecular Formula: | C16 H29 N3 O2 S |
| Smiles: | CCC(C)(C)C1CCC2(CC1)NC(N(CC(=O)OCC)N2)=S |
| Stereo: | ACHIRAL |
| logP: | 3.1555 |
| logD: | 3.1555 |
| logSw: | -2.9877 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.742 |
| InChI Key: | YCQNTGALEHWUOX-UHFFFAOYSA-N |