N-[(pyridin-4-yl)methyl]-4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzamide
Chemical Structure Depiction of
N-[(pyridin-4-yl)methyl]-4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzamide
N-[(pyridin-4-yl)methyl]-4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | S480-0222 |
| Compound Name: | N-[(pyridin-4-yl)methyl]-4-[(2,4,8,8-tetraoxo-8lambda~6~-thia-1,3-diazaspiro[4.5]decan-3-yl)methyl]benzamide |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C21 H22 N4 O5 S |
| Smiles: | C1CS(CCC12C(N(Cc1ccc(cc1)C(NCc1ccncc1)=O)C(N2)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4081 |
| logD: | -0.4115 |
| logSw: | -1.8535 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.75 |
| InChI Key: | JQUMGLSMMZVVJA-UHFFFAOYSA-N |