5-[(3-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(3-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(3-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0579 |
| Compound Name: | 5-[(3-chlorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 431.9 |
| Molecular Formula: | C25 H19 Cl F N3 O |
| Smiles: | Cc1ccc2c(c1)c1c(C(N(Cc3ccc(cc3)F)C=N1)=O)n2Cc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.624 |
| logD: | 5.624 |
| logSw: | -5.8156 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9284 |
| InChI Key: | WRRDCYKQIKESFU-UHFFFAOYSA-N |