N-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-tert-butyl-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
N-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-tert-butyl-N-(2-methylpropyl)benzamide
N-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-tert-butyl-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V018-3074 |
| Compound Name: | N-(2-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl)-4-tert-butyl-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C26 H30 N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(Nc1nnc(c2ccc3c(c2)OCO3)s1)=O)C(c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0718 |
| logD: | 6.0717 |
| logSw: | -5.4939 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.988 |
| InChI Key: | VWOKXRSWUBJIIX-UHFFFAOYSA-N |