ethyl 3-[3-(2-butanamido-1,3-benzothiazol-6-yl)propanamido]benzoate
Chemical Structure Depiction of
ethyl 3-[3-(2-butanamido-1,3-benzothiazol-6-yl)propanamido]benzoate
ethyl 3-[3-(2-butanamido-1,3-benzothiazol-6-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | F222-0656 |
| Compound Name: | ethyl 3-[3-(2-butanamido-1,3-benzothiazol-6-yl)propanamido]benzoate |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Smiles: | CCCC(Nc1nc2ccc(CCC(Nc3cccc(c3)C(=O)OCC)=O)cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.082 |
| logD: | 5.0819 |
| logSw: | -4.9073 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.781 |
| InChI Key: | JELADNXKAANWGB-UHFFFAOYSA-N |