N-(2-methyl-3-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(2-methyl-3-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
N-(2-methyl-3-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | C066-2154 |
| Compound Name: | N-(2-methyl-3-nitrophenyl)-4-oxo-4H-thieno[3,2-c][1]benzopyran-2-carboxamide |
| Molecular Weight: | 380.38 |
| Molecular Formula: | C19 H12 N2 O5 S |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)NC(c1cc2C(=O)Oc3ccccc3c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4521 |
| logD: | 4.4464 |
| logSw: | -4.504 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.381 |
| InChI Key: | VGCZPKBEQVNOSQ-UHFFFAOYSA-N |