[4-(4-methylbenzene-1-sulfonyl)-1-oxa-4,8-diazaspiro[4.5]decan-8-yl](3-nitrophenyl)methanone
Chemical Structure Depiction of
[4-(4-methylbenzene-1-sulfonyl)-1-oxa-4,8-diazaspiro[4.5]decan-8-yl](3-nitrophenyl)methanone
[4-(4-methylbenzene-1-sulfonyl)-1-oxa-4,8-diazaspiro[4.5]decan-8-yl](3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | G856-4670 |
| Compound Name: | [4-(4-methylbenzene-1-sulfonyl)-1-oxa-4,8-diazaspiro[4.5]decan-8-yl](3-nitrophenyl)methanone |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | Cc1ccc(cc1)S(N1CCOC12CCN(CC2)C(c1cccc(c1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3682 |
| logD: | 2.3682 |
| logSw: | -2.6799 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.957 |
| InChI Key: | UBIWJIWKAHRTRS-UHFFFAOYSA-N |