N-{5-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-N'-(3,5-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-{5-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-N'-(3,5-dimethoxyphenyl)urea
N-{5-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-N'-(3,5-dimethoxyphenyl)urea
Compound characteristics
Compound ID: | L337-0507 |
Compound Name: | N-{5-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}-N'-(3,5-dimethoxyphenyl)urea |
Molecular Weight: | 439.49 |
Molecular Formula: | C21 H21 N5 O4 S |
Smiles: | COc1cc(cc(c1)OC)NC(Nc1nnc(CC(N2CCc3ccccc23)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 4.0483 |
logD: | 4.0477 |
logSw: | -4.1557 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.821 |
InChI Key: | RIAHCEYNGAQIKO-UHFFFAOYSA-N |