methyl 4-[4-(azepane-1-sulfonyl)anilino]-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-[4-(azepane-1-sulfonyl)anilino]-4-oxobutanoate
methyl 4-[4-(azepane-1-sulfonyl)anilino]-4-oxobutanoate
Compound characteristics
| Compound ID: | 4478-7203 |
| Compound Name: | methyl 4-[4-(azepane-1-sulfonyl)anilino]-4-oxobutanoate |
| Molecular Weight: | 368.45 |
| Molecular Formula: | C17 H24 N2 O5 S |
| Smiles: | COC(CCC(Nc1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9443 |
| logD: | 1.9432 |
| logSw: | -2.7729 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.009 |
| InChI Key: | QPYUXPFHBOENOJ-UHFFFAOYSA-N |