N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethoxybenzamide
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | L470-0601 |
| Compound Name: | N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethoxybenzamide |
| Molecular Weight: | 438.56 |
| Molecular Formula: | C20 H26 N2 O5 S2 |
| Smiles: | COc1ccc(C(NCc2ccc(s2)S(N2CCCCCC2)(=O)=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.8714 |
| logD: | 3.8713 |
| logSw: | -4.0272 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.886 |
| InChI Key: | RTNMIAZPNSYNOB-UHFFFAOYSA-N |