N-benzyl-2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-ethylacetamide
Chemical Structure Depiction of
N-benzyl-2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-ethylacetamide
N-benzyl-2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-ethylacetamide
Compound characteristics
Compound ID: | E737-0507 |
Compound Name: | N-benzyl-2-(5,8-dimethyl-2,4-dioxo-3-phenyl-2,3,4,5-tetrahydro-1H-pyrimido[5,4-b]indol-1-yl)-N-ethylacetamide |
Molecular Weight: | 480.57 |
Molecular Formula: | C29 H28 N4 O3 |
Smiles: | CCN(Cc1ccccc1)C(CN1C(N(C(c2c1c1cc(C)ccc1n2C)=O)c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.976 |
logD: | 3.976 |
logSw: | -3.9662 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 49.416 |
InChI Key: | DOEBNCLVYVJFCS-UHFFFAOYSA-N |