N-(2-chloro-4-methylphenyl)-2-[(5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[(5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-(2-chloro-4-methylphenyl)-2-[(5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E514-0413 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[(5-methylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 386.86 |
| Molecular Formula: | C18 H15 Cl N4 O2 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CSc1c2cc3c(cco3)n2c(C)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2103 |
| logD: | 3.208 |
| logSw: | -3.3724 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.02 |
| InChI Key: | LXIOGKFGJLXKSM-UHFFFAOYSA-N |