2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C527-1036 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-[2-(4-ethylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 453 |
| Molecular Formula: | C21 H29 Cl N4 O3 S |
| Smiles: | CCN1CCN(CCNC(CS(Cc2c(C)oc(c3ccc(cc3)[Cl])n2)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.4931 |
| logD: | 0.7005 |
| logSw: | -2.922 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.965 |
| InChI Key: | KMHKAFMACJLOEW-UHFFFAOYSA-N |