N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(4-methylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(4-methylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(4-methylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K938-0802 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-{[(4-methylbenzene-1-sulfonyl)amino]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 474.62 |
| Molecular Formula: | C25 H34 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(NCC1CCC(CC1)C(NCCc1ccc(c(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8703 |
| logD: | 3.8703 |
| logSw: | -3.9279 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.704 |
| InChI Key: | CQNHKRTYJRQWEQ-UHFFFAOYSA-N |