N-(5-{[(4-methylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-3-(2,2,2-trifluoroacetamido)propanamide
Chemical Structure Depiction of
N-(5-{[(4-methylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-3-(2,2,2-trifluoroacetamido)propanamide
N-(5-{[(4-methylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-3-(2,2,2-trifluoroacetamido)propanamide
Compound characteristics
| Compound ID: | 8006-8658 |
| Compound Name: | N-(5-{[(4-methylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazol-2-yl)-3-phenyl-3-(2,2,2-trifluoroacetamido)propanamide |
| Molecular Weight: | 527.54 |
| Molecular Formula: | C21 H20 F3 N5 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(NCc1nnc(NC(CC(c2ccccc2)NC(C(F)(F)F)=O)=O)s1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6397 |
| logD: | 2.9884 |
| logSw: | -3.8968 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.23 |
| InChI Key: | HAODNUMPVQUQGU-INIZCTEOSA-N |