methyl 3-{[5-(4-methylphenyl)-3H-imidazo[1,2-b][1,2,4]triazol-6-yl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[5-(4-methylphenyl)-3H-imidazo[1,2-b][1,2,4]triazol-6-yl]amino}benzoate
methyl 3-{[5-(4-methylphenyl)-3H-imidazo[1,2-b][1,2,4]triazol-6-yl]amino}benzoate
Compound characteristics
| Compound ID: | J008-0559 |
| Compound Name: | methyl 3-{[5-(4-methylphenyl)-3H-imidazo[1,2-b][1,2,4]triazol-6-yl]amino}benzoate |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | Cc1ccc(cc1)c1c(Nc2cccc(c2)C(=O)OC)n2c(n1)[nH]cn2 |
| Stereo: | ACHIRAL |
| logP: | 3.7678 |
| logD: | 3.6159 |
| logSw: | -3.9562 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.015 |
| InChI Key: | CJPLCJXBPZJIRU-UHFFFAOYSA-N |