3-methyl-8-(4-methylbenzene-1-sulfonyl)-1-(1-phenylethyl)-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
3-methyl-8-(4-methylbenzene-1-sulfonyl)-1-(1-phenylethyl)-1,4,8-triazaspiro[4.5]decan-2-one
3-methyl-8-(4-methylbenzene-1-sulfonyl)-1-(1-phenylethyl)-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V026-2275 |
| Compound Name: | 3-methyl-8-(4-methylbenzene-1-sulfonyl)-1-(1-phenylethyl)-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 427.56 |
| Molecular Formula: | C23 H29 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC1C(N(C(C)c2ccccc2)C2(CCN(CC2)S(c2ccc(C)cc2)(=O)=O)N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5465 |
| logD: | 3.5325 |
| logSw: | -3.7682 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.116 |
| InChI Key: | ZOUDMGBZSGXGOC-UHFFFAOYSA-N |