3-(butan-2-yl)-8-(2,3-dichlorobenzene-1-sulfonyl)-1-ethyl-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
3-(butan-2-yl)-8-(2,3-dichlorobenzene-1-sulfonyl)-1-ethyl-1,4,8-triazaspiro[4.5]decan-2-one
3-(butan-2-yl)-8-(2,3-dichlorobenzene-1-sulfonyl)-1-ethyl-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V029-2239 |
| Compound Name: | 3-(butan-2-yl)-8-(2,3-dichlorobenzene-1-sulfonyl)-1-ethyl-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 448.41 |
| Molecular Formula: | C19 H27 Cl2 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCC(C)C1C(N(CC)C2(CCN(CC2)S(c2cccc(c2[Cl])[Cl])(=O)=O)N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9293 |
| logD: | 3.3897 |
| logSw: | -4.3336 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.273 |
| InChI Key: | PORXJHIISXLOOX-UHFFFAOYSA-N |