4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1,2-thiazole-3-carboxamide
Chemical Structure Depiction of
4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1,2-thiazole-3-carboxamide
4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1,2-thiazole-3-carboxamide
Compound characteristics
| Compound ID: | M050-0583 |
| Compound Name: | 4-amino-N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-1,2-thiazole-3-carboxamide |
| Molecular Weight: | 495.56 |
| Molecular Formula: | C24 H25 N5 O5 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(c1c(c(C(NCc2ccc3c(c2)OCO3)=O)ns1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6866 |
| logD: | 2.6865 |
| logSw: | -3.2607 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.868 |
| InChI Key: | VKJWXFABZRUGKC-UHFFFAOYSA-N |