N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide
N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 2806-0213 |
| Compound Name: | N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-2-[(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 458.45 |
| Molecular Formula: | C23 H14 N4 O5 S |
| Smiles: | C(C(Nc1ccc2C(c3ccccc3C(c2c1)=O)=O)=O)Sc1nc2cc(ccc2[nH]1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3806 |
| logD: | 3.7275 |
| logSw: | -4.5562 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.453 |
| InChI Key: | NNJASSVXGNYYOE-UHFFFAOYSA-N |