methyl 3-{[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazine-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazine-1-carbonyl]amino}benzoate
methyl 3-{[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazine-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G336-0074 |
| Compound Name: | methyl 3-{[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazine-1-carbonyl]amino}benzoate |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C19 H19 N5 O3 S |
| Smiles: | COC(c1cccc(c1)NC(N1CCN(CC1)c1nc2cccnc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3198 |
| logD: | 3.3175 |
| logSw: | -3.634 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.083 |
| InChI Key: | TVNJEDIPYAUBOS-UHFFFAOYSA-N |