1-(azepan-1-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methoxybenzene-1-sulfonyl]propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methoxybenzene-1-sulfonyl]propan-1-one
1-(azepan-1-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methoxybenzene-1-sulfonyl]propan-1-one
Compound characteristics
| Compound ID: | F382-1240 |
| Compound Name: | 1-(azepan-1-yl)-3-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methoxybenzene-1-sulfonyl]propan-1-one |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C21 H28 N2 O5 S |
| Smiles: | Cc1c(C)noc1c1ccc(c(c1)S(CCC(N1CCCCCC1)=O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0486 |
| logD: | 3.0486 |
| logSw: | -3.3557 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.702 |
| InChI Key: | MGJSHPWTRASLQD-UHFFFAOYSA-N |