ethyl 4-({5-[4-(methylsulfanyl)phenyl]-3H-imidazo[1,2-b][1,2,4]triazol-6-yl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({5-[4-(methylsulfanyl)phenyl]-3H-imidazo[1,2-b][1,2,4]triazol-6-yl}amino)benzoate
ethyl 4-({5-[4-(methylsulfanyl)phenyl]-3H-imidazo[1,2-b][1,2,4]triazol-6-yl}amino)benzoate
Compound characteristics
| Compound ID: | J008-0532 |
| Compound Name: | ethyl 4-({5-[4-(methylsulfanyl)phenyl]-3H-imidazo[1,2-b][1,2,4]triazol-6-yl}amino)benzoate |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C20 H19 N5 O2 S |
| Smiles: | CCOC(c1ccc(cc1)Nc1c(c2ccc(cc2)SC)nc2[nH]cnn12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3937 |
| logD: | 4.2419 |
| logSw: | -4.1514 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.595 |
| InChI Key: | KUPVPKWJBVWAHB-UHFFFAOYSA-N |