N-[2-(furan-2-yl)-2-(4-methylbenzene-1-sulfonyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-[2-(furan-2-yl)-2-(4-methylbenzene-1-sulfonyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-[2-(furan-2-yl)-2-(4-methylbenzene-1-sulfonyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | G857-1512 |
| Compound Name: | N-[2-(furan-2-yl)-2-(4-methylbenzene-1-sulfonyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C21 H21 N O7 S2 |
| Smiles: | Cc1ccc(cc1)S(C(CNS(c1ccc2c(c1)OCCO2)(=O)=O)c1ccco1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5331 |
| logD: | 2.533 |
| logSw: | -2.9325 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.899 |
| InChI Key: | LMRZINFFAOBYMR-NRFANRHFSA-N |