N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethylbenzamide
Chemical Structure Depiction of
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethylbenzamide
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethylbenzamide
Compound characteristics
| Compound ID: | L470-0679 |
| Compound Name: | N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-2,4-dimethylbenzamide |
| Molecular Weight: | 406.56 |
| Molecular Formula: | C20 H26 N2 O3 S2 |
| Smiles: | Cc1ccc(C(NCc2ccc(s2)S(N2CCCCCC2)(=O)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6998 |
| logD: | 4.6998 |
| logSw: | -4.222 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.712 |
| InChI Key: | QUDDEXIBFOXGHU-UHFFFAOYSA-N |