N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-[(4-bromobenzene-1-sulfonyl)(methyl)amino]-3-phenylbutanamide
Chemical Structure Depiction of
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-[(4-bromobenzene-1-sulfonyl)(methyl)amino]-3-phenylbutanamide
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-[(4-bromobenzene-1-sulfonyl)(methyl)amino]-3-phenylbutanamide
Compound characteristics
| Compound ID: | 8015-2457 |
| Compound Name: | N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-[(4-bromobenzene-1-sulfonyl)(methyl)amino]-3-phenylbutanamide |
| Molecular Weight: | 585.54 |
| Molecular Formula: | C26 H25 Br N4 O3 S2 |
| Smiles: | CN(CC(CC(Nc1nnc(Cc2ccccc2)s1)=O)c1ccccc1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1519 |
| logD: | 6.0727 |
| logSw: | -5.5108 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.449 |
| InChI Key: | LUBNNGUPGVRHEW-NRFANRHFSA-N |