3-amino-6-nitro-N-phenyl-4-(phenylsulfanyl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-amino-6-nitro-N-phenyl-4-(phenylsulfanyl)-1-benzothiophene-2-carboxamide
3-amino-6-nitro-N-phenyl-4-(phenylsulfanyl)-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8012-5617 |
| Compound Name: | 3-amino-6-nitro-N-phenyl-4-(phenylsulfanyl)-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C21 H15 N3 O3 S2 |
| Smiles: | c1ccc(cc1)NC(c1c(c2c(cc(cc2s1)[N+]([O-])=O)Sc1ccccc1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1538 |
| logD: | 5.1538 |
| logSw: | -5.4747 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.573 |
| InChI Key: | OUPVCLMTQABPOU-UHFFFAOYSA-N |