1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C797-1657 |
| Compound Name: | 1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-[3-(4-methylpiperazin-1-yl)propyl]piperidine-4-carboxamide |
| Molecular Weight: | 501.69 |
| Molecular Formula: | C26 H39 N5 O3 S |
| Smiles: | CCC1=C(c2ccc(C)cc2)S(N=C1N1CCC(CC1)C(NCCCN1CCN(C)CC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1452 |
| logD: | 0.9407 |
| logSw: | -2.7097 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.844 |
| InChI Key: | VHBUPOJHQSFUEV-UHFFFAOYSA-N |