1,1',1'',1'''-[6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosine-2,3,16,17-tetrayltetrakis(methylene)]tetra(pyrrolidin-2-one)
Chemical Structure Depiction of
1,1',1'',1'''-[6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosine-2,3,16,17-tetrayltetrakis(methylene)]tetra(pyrrolidin-2-one)
1,1',1'',1'''-[6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosine-2,3,16,17-tetrayltetrakis(methylene)]tetra(pyrrolidin-2-one)
Compound characteristics
| Compound ID: | 0523-0019 |
| Compound Name: | 1,1',1'',1'''-[6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosine-2,3,16,17-tetrayltetrakis(methylene)]tetra(pyrrolidin-2-one) |
| Molecular Weight: | 836.98 |
| Molecular Formula: | C44 H60 N4 O12 |
| Smiles: | C1CC(N(C1)Cc1cc2c(cc1CN1CCCC1=O)OCCOCCOCCOc1cc(CN3CCCC3=O)c(CN3CCCC3=O)cc1OCCOCCOCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | -2.1241 |
| logD: | -2.1241 |
| logSw: | -0.5187 |
| Hydrogen bond acceptors count: | 16 |
| Polar surface area: | 132.707 |
| InChI Key: | RQNJYUKWBAKHFC-UHFFFAOYSA-N |