2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
Compound ID: | E737-0034 |
Compound Name: | 2-[5,8-dimethyl-3-(4-methylphenyl)-2,4-dioxo-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl]-N-[(4-methylphenyl)methyl]acetamide |
Molecular Weight: | 480.57 |
Molecular Formula: | C29 H28 N4 O3 |
Smiles: | Cc1ccc(CNC(CN2C(N(C(c3c2c2cc(C)ccc2n3C)=O)c2ccc(C)cc2)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.6228 |
logD: | 4.6228 |
logSw: | -4.3237 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.207 |
InChI Key: | FGZPEANJHWMKPD-UHFFFAOYSA-N |