3-[2-(4-butoxybenzoyl)-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
Chemical Structure Depiction of
3-[2-(4-butoxybenzoyl)-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
3-[2-(4-butoxybenzoyl)-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
Compound characteristics
| Compound ID: | 4137-0390 |
| Compound Name: | 3-[2-(4-butoxybenzoyl)-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C25 H32 N4 O5 S |
| Smiles: | CCCCOc1ccc(cc1)C(NN(CCC(NC(C)(C)C)=O)C1c2ccccc2S(N=1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5428 |
| logD: | 3.3298 |
| logSw: | -3.7027 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.872 |
| InChI Key: | DFZUHQBUKHNZEJ-UHFFFAOYSA-N |