methyl 2-({1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidine-4-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidine-4-carbonyl}amino)benzoate
methyl 2-({1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidine-4-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | G207-1594 |
| Compound Name: | methyl 2-({1-[4-ethyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidine-4-carbonyl}amino)benzoate |
| Molecular Weight: | 495.6 |
| Molecular Formula: | C26 H29 N3 O5 S |
| Smiles: | CCC1=C(c2ccc(C)cc2)S(N=C1N1CCC(CC1)C(Nc1ccccc1C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1307 |
| logD: | 4.0624 |
| logSw: | -4.0822 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.698 |
| InChI Key: | AGVNIWOMZLFSQS-UHFFFAOYSA-N |