7-({benzyl[(3,4-dimethoxyphenyl)methyl]amino}methyl)-3-(4-fluorophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({benzyl[(3,4-dimethoxyphenyl)methyl]amino}methyl)-3-(4-fluorophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-({benzyl[(3,4-dimethoxyphenyl)methyl]amino}methyl)-3-(4-fluorophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G769-0779 |
| Compound Name: | 7-({benzyl[(3,4-dimethoxyphenyl)methyl]amino}methyl)-3-(4-fluorophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 515.61 |
| Molecular Formula: | C29 H26 F N3 O3 S |
| Smiles: | COc1ccc(CN(CC2=CC(N3C(=CSC3=N2)c2ccc(cc2)F)=O)Cc2ccccc2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.5452 |
| logD: | 4.0564 |
| logSw: | -4.4967 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 44.697 |
| InChI Key: | BMEBWCUPWAYGPS-UHFFFAOYSA-N |