N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-(2,4-dimethoxybenzoyl)isoleucinamide
Chemical Structure Depiction of
N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-(2,4-dimethoxybenzoyl)isoleucinamide
N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-(2,4-dimethoxybenzoyl)isoleucinamide
Compound characteristics
| Compound ID: | V017-2799 |
| Compound Name: | N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-N~2~-(2,4-dimethoxybenzoyl)isoleucinamide |
| Molecular Weight: | 533.44 |
| Molecular Formula: | C23 H25 Br N4 O4 S |
| Salt: | not_available |
| Smiles: | CCC(C)C(C(Nc1nnc(c2cccc(c2)[Br])s1)=O)NC(c1ccc(cc1OC)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0264 |
| logD: | 6.0261 |
| logSw: | -5.4786 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.814 |
| InChI Key: | DSAXVVFTRFCSHG-UHFFFAOYSA-N |