N-[(2H-1,3-benzodioxol-5-yl)methyl]-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonamide
Compound characteristics
| Compound ID: | E975-1321 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonamide |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | C1CCc2c3cc(ccc3[nH]c2CC1)S(NCc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0161 |
| logD: | 4.016 |
| logSw: | -4.2398 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.214 |
| InChI Key: | ZPUPAPOBGXFTTL-UHFFFAOYSA-N |