3-chloro-N-[3-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[3-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide
3-chloro-N-[3-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8377-1241 |
| Compound Name: | 3-chloro-N-[3-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-7-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 479.9 |
| Molecular Formula: | C23 H14 Cl N3 O5 S |
| Smiles: | COc1ccc2c(c1)nc(c1cccc(c1)NC(c1c(c3cccc(c3s1)[N+]([O-])=O)[Cl])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.2402 |
| logD: | 6.2402 |
| logSw: | -6.473 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.511 |
| InChI Key: | SBILVVJBITVAMK-UHFFFAOYSA-N |