(azepan-1-yl)(4-{5-methyl-4-[(4-methylbenzene-1-sulfonyl)methyl]-1,3-oxazol-2-yl}phenyl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(4-{5-methyl-4-[(4-methylbenzene-1-sulfonyl)methyl]-1,3-oxazol-2-yl}phenyl)methanone
(azepan-1-yl)(4-{5-methyl-4-[(4-methylbenzene-1-sulfonyl)methyl]-1,3-oxazol-2-yl}phenyl)methanone
Compound characteristics
| Compound ID: | E776-1771 |
| Compound Name: | (azepan-1-yl)(4-{5-methyl-4-[(4-methylbenzene-1-sulfonyl)methyl]-1,3-oxazol-2-yl}phenyl)methanone |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C25 H28 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(Cc1c(C)oc(c2ccc(cc2)C(N2CCCCCC2)=O)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2175 |
| logD: | 4.2175 |
| logSw: | -4.0814 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.104 |
| InChI Key: | QMVVZQQSHJYPPD-UHFFFAOYSA-N |