N-{4-methyl-2-[2-(3-methylthiophen-2-yl)azepane-1-sulfonyl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-methyl-2-[2-(3-methylthiophen-2-yl)azepane-1-sulfonyl]phenyl}acetamide
N-{4-methyl-2-[2-(3-methylthiophen-2-yl)azepane-1-sulfonyl]phenyl}acetamide
Compound characteristics
| Compound ID: | J005-0907 |
| Compound Name: | N-{4-methyl-2-[2-(3-methylthiophen-2-yl)azepane-1-sulfonyl]phenyl}acetamide |
| Molecular Weight: | 406.56 |
| Molecular Formula: | C20 H26 N2 O3 S2 |
| Smiles: | CC(Nc1ccc(C)cc1S(N1CCCCCC1c1c(C)ccs1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8479 |
| logD: | 3.8478 |
| logSw: | -3.6906 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.062 |
| InChI Key: | SIBOPRWBUDCYDA-SFHVURJKSA-N |