ethyl 4-[(4-{methyl[2-(morpholin-4-yl)ethyl]amino}piperidine-1-carbothioyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(4-{methyl[2-(morpholin-4-yl)ethyl]amino}piperidine-1-carbothioyl)amino]benzoate
ethyl 4-[(4-{methyl[2-(morpholin-4-yl)ethyl]amino}piperidine-1-carbothioyl)amino]benzoate
Compound characteristics
| Compound ID: | K788-7011 |
| Compound Name: | ethyl 4-[(4-{methyl[2-(morpholin-4-yl)ethyl]amino}piperidine-1-carbothioyl)amino]benzoate |
| Molecular Weight: | 434.6 |
| Molecular Formula: | C22 H34 N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCC(CC1)N(C)CCN1CCOCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8604 |
| logD: | 1.1213 |
| logSw: | -3.2841 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.355 |
| InChI Key: | ZYXQOWVPKWBRJD-UHFFFAOYSA-N |