{2-amino-1-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]indolizin-3-yl}(2,5-dimethoxyphenyl)methanone
Chemical Structure Depiction of
{2-amino-1-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]indolizin-3-yl}(2,5-dimethoxyphenyl)methanone
{2-amino-1-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]indolizin-3-yl}(2,5-dimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | D031-0047 |
| Compound Name: | {2-amino-1-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]indolizin-3-yl}(2,5-dimethoxyphenyl)methanone |
| Molecular Weight: | 499.54 |
| Molecular Formula: | C27 H21 N3 O5 S |
| Smiles: | COc1ccc(c(c1)C(c1c(c(c2ccccn12)c1nc(cs1)c1ccc2c(c1)OCO2)N)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2881 |
| logD: | 5.2881 |
| logSw: | -5.4415 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.302 |
| InChI Key: | XKPOTLJYIFFNPY-UHFFFAOYSA-N |