1-[(2,5-dimethylphenyl)methyl]-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
1-[(2,5-dimethylphenyl)methyl]-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-0503 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-5,8-dimethyl-3-phenyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C27 H25 N3 O2 |
| Smiles: | Cc1ccc(C)c(CN2C(N(C(c3c2c2cc(C)ccc2n3C)=O)c2ccccc2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7169 |
| logD: | 5.7169 |
| logSw: | -5.4471 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.736 |
| InChI Key: | DPEBDSZDIGKQON-UHFFFAOYSA-N |