2-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
Compound ID: | L690-0155 |
Compound Name: | 2-{3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl}-N-[(4-methylphenyl)methyl]acetamide |
Molecular Weight: | 442.48 |
Molecular Formula: | C24 H22 N6 O3 |
Smiles: | [H]c1ccc2c(c1)c1c(C(N(Cc3nc(C)no3)C=N1)=O)n2CC(NCc1ccc(C)cc1)=O |
Stereo: | ACHIRAL |
logP: | 2.4871 |
logD: | 2.4871 |
logSw: | -2.7055 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.627 |
InChI Key: | IPQRQXIMNKUTQW-UHFFFAOYSA-N |