4-butyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-butyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]cyclohexane-1-carboxamide
4-butyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D111-0121 |
| Compound Name: | 4-butyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 481.65 |
| Molecular Formula: | C25 H39 N O6 S |
| Smiles: | CCCCC1CCC(CC1)C(N(Cc1cc(c(c(c1)OC)OC)OC)C1CCS(C1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9012 |
| logD: | 3.9012 |
| logSw: | -3.9296 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.03 |
| InChI Key: | QDCQRZQYZXFMKF-DQVLVPHSSA-N |