N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F533-0151 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[2,5-dimethyl-4-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxamide |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C25 H32 N4 O6 S |
| Smiles: | Cc1c(C(N2CCCC2)=O)c(c(C)[nH]1)S(N1CCC(CC1)C(Nc1ccc2c(c1)OCCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0178 |
| logD: | 1.0176 |
| logSw: | -2.4341 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.666 |
| InChI Key: | VSVGDXVDBLKABW-UHFFFAOYSA-N |