4-[(furan-2-yl)methyl]-8-(4-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
4-[(furan-2-yl)methyl]-8-(4-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
4-[(furan-2-yl)methyl]-8-(4-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
Compound characteristics
| Compound ID: | V031-0301 |
| Compound Name: | 4-[(furan-2-yl)methyl]-8-(4-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one |
| Molecular Weight: | 401.44 |
| Molecular Formula: | C19 H19 N3 O5 S |
| Salt: | not_available |
| Smiles: | C1CN(CCC12N(Cc1ccco1)C(CS2)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2332 |
| logD: | 2.2332 |
| logSw: | -2.4856 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.31 |
| InChI Key: | XMYPWGQERDDMMA-UHFFFAOYSA-N |