N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | C626-0080 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[4-(propan-2-yl)phenyl]-N~2~-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)glycinamide |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | CC(C)c1ccc(cc1)N(CC(NCc1ccc2c(c1)OCO2)=O)S(c1c(C)nn(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0479 |
| logD: | 3.0479 |
| logSw: | -3.3959 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.219 |
| InChI Key: | BHNPTVFLXFCWNZ-UHFFFAOYSA-N |