N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-0937 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C21 H27 N3 O5 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)c(C(Nc2ccc3c(c2)OCCO3)=O)[nH]c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2311 |
| logD: | 2.2278 |
| logSw: | -2.9956 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.845 |
| InChI Key: | MXCXQAUPYWISIK-UHFFFAOYSA-N |