N-[2-(azepan-1-yl)ethyl]-4-{4-[(4-ethylbenzene-1-sulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}benzamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-4-{4-[(4-ethylbenzene-1-sulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}benzamide
N-[2-(azepan-1-yl)ethyl]-4-{4-[(4-ethylbenzene-1-sulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}benzamide
Compound characteristics
| Compound ID: | C796-1329 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-4-{4-[(4-ethylbenzene-1-sulfonyl)methyl]-5-methyl-1,3-oxazol-2-yl}benzamide |
| Molecular Weight: | 509.67 |
| Molecular Formula: | C28 H35 N3 O4 S |
| Smiles: | CCc1ccc(cc1)S(Cc1c(C)oc(c2ccc(cc2)C(NCCN2CCCCCC2)=O)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4889 |
| logD: | 3.5121 |
| logSw: | -3.911 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.694 |
| InChI Key: | JGBNEJGINQSJLN-UHFFFAOYSA-N |