ethyl 4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)methyl]carbamothioyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)methyl]carbamothioyl}amino)benzoate
ethyl 4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)methyl]carbamothioyl}amino)benzoate
Compound characteristics
| Compound ID: | C087-0140 |
| Compound Name: | ethyl 4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)methyl]carbamothioyl}amino)benzoate |
| Molecular Weight: | 391.55 |
| Molecular Formula: | C19 H25 N3 O2 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(N(CCN(C)C)Cc1cccs1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2202 |
| logD: | 1.56 |
| logSw: | -3.9344 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.316 |
| InChI Key: | HUSBTGWYEQTSSS-UHFFFAOYSA-N |