2-cyano-3-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-3553 |
| Compound Name: | 2-cyano-3-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Smiles: | CCCc1nnc(NC(C(=C/c2ccc(c(c2)OC)OCc2ccccc2F)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.99 |
| logD: | 3.06 |
| logSw: | -5.83 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 158.87 |
| InChI Key: | PLIVBZHTYLJSGG-UHFFFAOYSA-N |