N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-5-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-5-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-5-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | M330-0074 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-methyl-5-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 488.58 |
| Molecular Formula: | C22 H24 N4 O5 S2 |
| Smiles: | Cc1c(C(N2CCCC2)=O)sc(c2cc(cn2C)S(NCc2ccc3c(c2)OCO3)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1711 |
| logD: | 3.1708 |
| logSw: | -3.3822 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.747 |
| InChI Key: | DFHMOJZOYWKYRH-UHFFFAOYSA-N |