ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4571-0006 |
| Compound Name: | ethyl 2-{2-[(1,3-benzothiazol-2-yl)sulfanyl]butanamido}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C18 H19 N3 O3 S3 |
| Smiles: | CCC(C(Nc1nc(C)c(C(=O)OCC)s1)=O)Sc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5026 |
| logD: | 5.3988 |
| logSw: | -5.426 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.788 |
| InChI Key: | ZBLLIMZTYJVGCF-LBPRGKRZSA-N |