2-nitrophenyl 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
2-nitrophenyl 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate
2-nitrophenyl 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 7884-0861 |
| Compound Name: | 2-nitrophenyl 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 363.77 |
| Molecular Formula: | C16 H10 Cl N O5 S |
| Smiles: | COc1ccc2c(c(C(=O)Oc3ccccc3[N+]([O-])=O)sc2c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.806 |
| logD: | 4.806 |
| logSw: | -5.24 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.074 |
| InChI Key: | VMDLNRLPRKOTFJ-UHFFFAOYSA-N |