8-(2,3-dichlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-[(oxolan-2-yl)methyl]-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
8-(2,3-dichlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-[(oxolan-2-yl)methyl]-1,4,8-triazaspiro[4.5]decan-2-one
8-(2,3-dichlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-[(oxolan-2-yl)methyl]-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V028-0694 |
| Compound Name: | 8-(2,3-dichlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-[(oxolan-2-yl)methyl]-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 504.48 |
| Molecular Formula: | C22 H31 Cl2 N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CC1C(N(CC2CCCO2)C2(CCN(CC2)S(c2cccc(c2[Cl])[Cl])(=O)=O)N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6663 |
| logD: | 2.7077 |
| logSw: | -4.0629 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.037 |
| InChI Key: | KOGJNKKQKOBHII-UHFFFAOYSA-N |