N-(3-chloro-2-methylphenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E514-0559 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(2,5-dimethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 400.88 |
| Molecular Formula: | C19 H17 Cl N4 O2 S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1c2cc3c(cc(C)o3)n2c(C)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.839 |
| logD: | 3.8367 |
| logSw: | -4.0662 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.534 |
| InChI Key: | ADEOPIWYDQUJOO-UHFFFAOYSA-N |