2-cyano-N~1~-(5-heptyl-1,3,4-thiadiazol-2-yl)-3-(1H-indol-3-yl)acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-heptyl-1,3,4-thiadiazol-2-yl)-3-(1H-indol-3-yl)acrylamide
2-cyano-N~1~-(5-heptyl-1,3,4-thiadiazol-2-yl)-3-(1H-indol-3-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-3117 |
| Compound Name: | 2-cyano-N~1~-(5-heptyl-1,3,4-thiadiazol-2-yl)-3-(1H-indol-3-yl)acrylamide |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C21 H23 N5 O S |
| Smiles: | CCCCCCCc1nnc(NC(C(=C/c2c[nH]c3ccccc23)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.83 |
| logD: | 3.48 |
| logSw: | -6.31 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 158.09 |
| InChI Key: | JDRHHJQLWLKOTH-UHFFFAOYSA-N |