N-(2H-1,3-benzodioxol-5-yl)-2-[3-({2-[(prop-2-en-1-yl)carbamothioyl]hydrazinylidene}methyl)-1H-indol-1-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[3-({2-[(prop-2-en-1-yl)carbamothioyl]hydrazinylidene}methyl)-1H-indol-1-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[3-({2-[(prop-2-en-1-yl)carbamothioyl]hydrazinylidene}methyl)-1H-indol-1-yl]acetamide
Compound characteristics
| Compound ID: | 6372-4128 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[3-({2-[(prop-2-en-1-yl)carbamothioyl]hydrazinylidene}methyl)-1H-indol-1-yl]acetamide |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C22 H21 N5 O3 S |
| Smiles: | C=CCNC(N/N=C\c1cn(CC(Nc2ccc3c(c2)OCO3)=O)c2ccccc12)=S |
| Stereo: | ACHIRAL |
| logP: | 3.8611 |
| logD: | 3.861 |
| logSw: | -4.0824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.718 |
| InChI Key: | XEVOIXBWAKIETJ-UHFFFAOYSA-N |