5-[(2-chloro-6-fluorophenyl)methyl]-3-[(2-methoxyphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
5-[(2-chloro-6-fluorophenyl)methyl]-3-[(2-methoxyphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
5-[(2-chloro-6-fluorophenyl)methyl]-3-[(2-methoxyphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | F400-0098 |
| Compound Name: | 5-[(2-chloro-6-fluorophenyl)methyl]-3-[(2-methoxyphenyl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 447.9 |
| Molecular Formula: | C25 H19 Cl F N3 O2 |
| Smiles: | [H]c1ccc2c(c1)c1c(C(N(Cc3ccccc3OC)C=N1)=O)n2Cc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 5.2694 |
| logD: | 5.2694 |
| logSw: | -5.7875 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.559 |
| InChI Key: | HRJOAAVGACPYBE-UHFFFAOYSA-N |