1,1'-{2,5-dimethyl-1-[5-methyl-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrrole-3,4-diyl}di(ethan-1-one)
Chemical Structure Depiction of
1,1'-{2,5-dimethyl-1-[5-methyl-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrrole-3,4-diyl}di(ethan-1-one)
1,1'-{2,5-dimethyl-1-[5-methyl-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrrole-3,4-diyl}di(ethan-1-one)
Compound characteristics
Compound ID: | 6557-0060 |
Compound Name: | 1,1'-{2,5-dimethyl-1-[5-methyl-4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrrole-3,4-diyl}di(ethan-1-one) |
Molecular Weight: | 444.55 |
Molecular Formula: | C26 H24 N2 O3 S |
Smiles: | CC(c1c(C(C)=O)c(C)n(c1C)c1nc(c2ccc(cc2)Oc2ccccc2)c(C)s1)=O |
Stereo: | ACHIRAL |
logP: | 5.5833 |
logD: | 5.5833 |
logSw: | -5.6711 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.4 |
InChI Key: | CFUGKXULVCHFFX-UHFFFAOYSA-N |