3-[(2-chlorophenyl)methyl]-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
3-[(2-chlorophenyl)methyl]-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Compound characteristics
| Compound ID: | IB08-2462 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one |
| Molecular Weight: | 451.91 |
| Molecular Formula: | C26 H18 Cl N5 O |
| Smiles: | Cc1cccc(c1)n1c2c(C(N(Cc3ccccc3[Cl])C=N2)=O)c2c1nc1ccccc1n2 |
| Stereo: | ACHIRAL |
| logP: | 5.65 |
| logD: | 5.65 |
| logSw: | -6.48 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 67.74 |
| InChI Key: | UAFDPKXIBVAUTK-UHFFFAOYSA-N |