5-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-1,5-diazacycloundecan-2-one
5-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S782-0261 |
| Compound Name: | 5-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 368.45 |
| Molecular Formula: | C17 H24 N2 O5 S |
| Smiles: | C1CCCN(CCC(NCC1)=O)S(c1ccc2c(c1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.781 |
| logD: | 0.781 |
| logSw: | -2.364 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.127 |
| InChI Key: | LLILYAVEGLBFSO-UHFFFAOYSA-N |