3-(3-methylbenzene-1-sulfonyl)-3,9-diazaspiro[5.6]dodecan-10-one
Chemical Structure Depiction of
3-(3-methylbenzene-1-sulfonyl)-3,9-diazaspiro[5.6]dodecan-10-one
3-(3-methylbenzene-1-sulfonyl)-3,9-diazaspiro[5.6]dodecan-10-one
Compound characteristics
| Compound ID: | S509-0100 |
| Compound Name: | 3-(3-methylbenzene-1-sulfonyl)-3,9-diazaspiro[5.6]dodecan-10-one |
| Molecular Weight: | 336.45 |
| Molecular Formula: | C17 H24 N2 O3 S |
| Smiles: | Cc1cccc(c1)S(N1CCC2(CCC(NCC2)=O)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6014 |
| logD: | 1.6014 |
| logSw: | -2.5352 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.224 |
| InChI Key: | IKCQVRITYGZMMS-UHFFFAOYSA-N |