ethyl 4-({[3-(diethylamino)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[3-(diethylamino)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate
ethyl 4-({[3-(diethylamino)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | C087-0122 |
| Compound Name: | ethyl 4-({[3-(diethylamino)propyl][(furan-2-yl)methyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | CCN(CC)CCCN(Cc1ccco1)C(Nc1ccc(cc1)C(=O)OCC)=S |
| Stereo: | ACHIRAL |
| logP: | 4.8769 |
| logD: | 2.6905 |
| logSw: | -4.3068 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.591 |
| InChI Key: | XQAXSYNSDJUEKA-UHFFFAOYSA-N |