methyl 3-[(2-propanamido-1,3-benzothiazol-6-yl)carbamamido]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(2-propanamido-1,3-benzothiazol-6-yl)carbamamido]thiophene-2-carboxylate
methyl 3-[(2-propanamido-1,3-benzothiazol-6-yl)carbamamido]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | F690-0081 |
| Compound Name: | methyl 3-[(2-propanamido-1,3-benzothiazol-6-yl)carbamamido]thiophene-2-carboxylate |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C17 H16 N4 O4 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NC(CC)=O)s2)NC(Nc1ccsc1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6787 |
| logD: | 3.6742 |
| logSw: | -3.9382 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.947 |
| InChI Key: | IDNMVXMVKKHIOI-UHFFFAOYSA-N |