ethyl 4-(butyl{[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-(butyl{[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate
ethyl 4-(butyl{[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate
Compound characteristics
| Compound ID: | 5692-1582 |
| Compound Name: | ethyl 4-(butyl{[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetyl}amino)benzoate |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C21 H24 N4 O3 S |
| Smiles: | CCCCN(C(CSc1nc2cccnc2[nH]1)=O)c1ccc(cc1)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.996 |
| logD: | 3.9883 |
| logSw: | -3.8431 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.453 |
| InChI Key: | QIHPOYIUORRIPM-UHFFFAOYSA-N |