5,8-dimethyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
5,8-dimethyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
5,8-dimethyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-0192 |
| Compound Name: | 5,8-dimethyl-3-(3-methylphenyl)-1-[(3-methylphenyl)methyl]-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C27 H25 N3 O2 |
| Smiles: | Cc1cccc(CN2C(N(C(c3c2c2cc(C)ccc2n3C)=O)c2cccc(C)c2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.9374 |
| logD: | 5.9374 |
| logSw: | -5.4588 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.736 |
| InChI Key: | WQROBXYHKIKUQA-UHFFFAOYSA-N |