N-({rel-(3R,4S)-3-(dimethylamino)-1-[(3-methylthiophen-2-yl)methyl]piperidin-4-yl}methyl)-N'-methylurea
Chemical Structure Depiction of
N-({rel-(3R,4S)-3-(dimethylamino)-1-[(3-methylthiophen-2-yl)methyl]piperidin-4-yl}methyl)-N'-methylurea
N-({rel-(3R,4S)-3-(dimethylamino)-1-[(3-methylthiophen-2-yl)methyl]piperidin-4-yl}methyl)-N'-methylurea
Compound characteristics
| Compound ID: | S618-1829 |
| Compound Name: | N-({rel-(3R,4S)-3-(dimethylamino)-1-[(3-methylthiophen-2-yl)methyl]piperidin-4-yl}methyl)-N'-methylurea |
| Molecular Weight: | 324.49 |
| Molecular Formula: | C16 H28 N4 O S |
| Smiles: | Cc1ccsc1CN1CC[C@H](CNC(NC)=O)[C@@H](C1)N(C)C |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0796 |
| logD: | -0.3596 |
| logSw: | -2.1702 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.203 |
| InChI Key: | AEZPFVOKBIDHBE-KGLIPLIRSA-N |