N~3~-[(furan-2-yl)methyl]-N~3~-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-N-[3-(morpholin-4-yl)propyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-[(furan-2-yl)methyl]-N~3~-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-N-[3-(morpholin-4-yl)propyl]-beta-alaninamide
N~3~-[(furan-2-yl)methyl]-N~3~-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-N-[3-(morpholin-4-yl)propyl]-beta-alaninamide
Compound characteristics
| Compound ID: | V005-2615 |
| Compound Name: | N~3~-[(furan-2-yl)methyl]-N~3~-{3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl}-N-[3-(morpholin-4-yl)propyl]-beta-alaninamide |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C25 H33 N5 O4 S |
| Smiles: | COc1cccc(Cc2nc(N(CCC(NCCCN3CCOCC3)=O)Cc3ccco3)sn2)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7116 |
| logD: | 2.2881 |
| logSw: | -3.1753 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.809 |
| InChI Key: | HOBPFEQZZYXUJQ-UHFFFAOYSA-N |