N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-3,5-dimethylbenzamide
Chemical Structure Depiction of
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-3,5-dimethylbenzamide
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-3,5-dimethylbenzamide
Compound characteristics
| Compound ID: | L470-0655 |
| Compound Name: | N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-3,5-dimethylbenzamide |
| Molecular Weight: | 406.56 |
| Molecular Formula: | C20 H26 N2 O3 S2 |
| Smiles: | Cc1cc(C)cc(c1)C(NCc1ccc(s1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3991 |
| logD: | 4.3991 |
| logSw: | -4.1767 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.712 |
| InChI Key: | JXOVJYIMMHLDQN-UHFFFAOYSA-N |