1-benzyl-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
1-benzyl-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
1-benzyl-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
Compound ID: | E737-0549 |
Compound Name: | 1-benzyl-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
Molecular Weight: | 395.46 |
Molecular Formula: | C25 H21 N3 O2 |
Smiles: | Cc1ccc2c(c1)c1c(C(N(C(N1Cc1ccccc1)=O)c1ccccc1)=O)n2C |
Stereo: | ACHIRAL |
logP: | 4.6709 |
logD: | 4.6709 |
logSw: | -4.4608 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 33.736 |
InChI Key: | KJAPQWRUMUMSOG-UHFFFAOYSA-N |