N-[4-(pyrrolidine-1-sulfonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[4-(pyrrolidine-1-sulfonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[4-(pyrrolidine-1-sulfonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y032-2489 |
| Compound Name: | N-[4-(pyrrolidine-1-sulfonyl)phenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 374.41 |
| Molecular Formula: | C18 H18 N2 O5 S |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)NC(c1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7101 |
| logD: | 2.7078 |
| logSw: | -3.3743 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.522 |
| InChI Key: | OIKPTRQTPYSRFZ-UHFFFAOYSA-N |