N-butyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-butyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2H-1,3-benzodioxole-5-carboxamide
N-butyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V010-7786 |
| Compound Name: | N-butyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C24 H26 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCCN(CCC(Nc1nnc(c2ccc(C)cc2)s1)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5584 |
| logD: | 4.5581 |
| logSw: | -4.2055 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.944 |
| InChI Key: | IQZHWNMFHVLAJP-UHFFFAOYSA-N |