ethyl 4-({[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]carbamothioyl}amino)benzoate
ethyl 4-({[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | Y503-4013 |
| Compound Name: | ethyl 4-({[7-(morpholin-4-yl)-2,1,3-benzoxadiazol-4-yl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C20 H21 N5 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(Nc1ccc(c2c1non2)N1CCOCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.485 |
| logD: | 4.485 |
| logSw: | -4.0491 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.037 |
| InChI Key: | IBSNBDPRRWMWCI-UHFFFAOYSA-N |