4-benzyl-8-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione
Chemical Structure Depiction of
4-benzyl-8-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione
4-benzyl-8-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione
Compound characteristics
| Compound ID: | T140-1448 |
| Compound Name: | 4-benzyl-8-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | C1CCc2c(C1)c(C(N1CCC3(CC1)N(Cc1ccccc1)C(CS3(=O)=O)=O)=O)no2 |
| Stereo: | ACHIRAL |
| logP: | 1.7112 |
| logD: | 1.6456 |
| logSw: | -2.1926 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.078 |
| InChI Key: | KZPPGXFPOSQLHZ-UHFFFAOYSA-N |