methyl 4-{[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]carbamoyl}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]carbamoyl}benzoate
methyl 4-{[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]carbamoyl}benzoate
Compound characteristics
| Compound ID: | G786-1229 |
| Compound Name: | methyl 4-{[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]carbamoyl}benzoate |
| Molecular Weight: | 389.41 |
| Molecular Formula: | C16 H11 N3 O5 S2 |
| Smiles: | COC(c1ccc(cc1)C(Nc1nc(cs1)c1cc(cs1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2899 |
| logD: | 4.2886 |
| logSw: | -4.4332 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.678 |
| InChI Key: | WLXDBEWNQITVMA-UHFFFAOYSA-N |