N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K938-0659 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 502.67 |
| Molecular Formula: | C27 H38 N2 O5 S |
| Smiles: | Cc1cc(C)c(c(C)c1)S(NCC1CCC(CC1)C(NCCc1ccc(c(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6658 |
| logD: | 4.6657 |
| logSw: | -4.3987 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.704 |
| InChI Key: | JMQLUHZCGBMLMS-UHFFFAOYSA-N |