N-(3-methylbutyl)-1-{3-methyl-5-[2-(thiophen-2-yl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-1-{3-methyl-5-[2-(thiophen-2-yl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-(3-methylbutyl)-1-{3-methyl-5-[2-(thiophen-2-yl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C514-0204 |
| Compound Name: | N-(3-methylbutyl)-1-{3-methyl-5-[2-(thiophen-2-yl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 451.61 |
| Molecular Formula: | C21 H29 N3 O4 S2 |
| Smiles: | CC(C)CCNC(C1CCN(CC1)S(c1c(C)noc1/C=C/c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9673 |
| logD: | 2.9673 |
| logSw: | -3.2556 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.01 |
| InChI Key: | GMJYSMJMALHIKW-UHFFFAOYSA-N |