N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea
N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | T377-0086 |
| Compound Name: | N-{1-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]piperidin-4-yl}-N'-(prop-2-en-1-yl)urea |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C20 H26 N4 O3 S |
| Smiles: | CC1=C(c2ccc(C)cc2)S(N=C1N1CCC(CC1)NC(NCC=C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4207 |
| logD: | 2.4207 |
| logSw: | -2.758 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.724 |
| InChI Key: | KPHOBIOTGBEMFF-UHFFFAOYSA-N |