N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Compound characteristics
| Compound ID: | L690-0638 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{8-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide |
| Molecular Weight: | 486.49 |
| Molecular Formula: | C25 H22 N6 O5 |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3nc(C)no3)C=N1)=O)n2CC(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0282 |
| logD: | 2.0281 |
| logSw: | -2.9013 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.128 |
| InChI Key: | NAOKACXJLSVCDJ-UHFFFAOYSA-N |