methyl 4-({4-methyl-2-[1-(propan-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-thiazole-5-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({4-methyl-2-[1-(propan-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-thiazole-5-carbonyl}amino)benzoate
methyl 4-({4-methyl-2-[1-(propan-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-thiazole-5-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | P611-0589 |
| Compound Name: | methyl 4-({4-methyl-2-[1-(propan-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-1,3-thiazole-5-carbonyl}amino)benzoate |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | CC(C)n1cc(c2cccnc12)c1nc(C)c(C(Nc2ccc(cc2)C(=O)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5117 |
| logD: | 4.507 |
| logSw: | -4.1626 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.516 |
| InChI Key: | ZXLQYJPZFJMQEX-UHFFFAOYSA-N |