3-chloro-N-methyl-6-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-methyl-6-nitro-1-benzothiophene-2-carboxamide
3-chloro-N-methyl-6-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y509-0198 |
| Compound Name: | 3-chloro-N-methyl-6-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 270.69 |
| Molecular Formula: | C10 H7 Cl N2 O3 S |
| Smiles: | CNC(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8569 |
| logD: | 2.8569 |
| logSw: | -3.9143 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.202 |
| InChI Key: | JSFCPSSKEPUHAN-UHFFFAOYSA-N |