N-(2-ethyl-6-methylphenyl)-2-{8-methyl-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-{8-methyl-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
N-(2-ethyl-6-methylphenyl)-2-{8-methyl-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide
Compound characteristics
| Compound ID: | C200-9476 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-{8-methyl-4-oxo-3-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}acetamide |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C28 H30 N6 O3 |
| Smiles: | CCCc1nc(CN2C=Nc3c4cc(C)ccc4n(CC(Nc4c(C)cccc4CC)=O)c3C2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.9276 |
| logD: | 4.9276 |
| logSw: | -4.6624 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.287 |
| InChI Key: | RLIXGYOUWLLXED-UHFFFAOYSA-N |