7-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-2453 |
| Compound Name: | 7-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 468.58 |
| Molecular Formula: | C27 H24 N4 O2 S |
| Smiles: | COc1ccc(CN(CC2=CC(N3C(=N2)SC(c2ccccc2)=N3)=O)Cc2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5974 |
| logD: | 4.5808 |
| logSw: | -4.4638 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.255 |
| InChI Key: | DXVQOQKZROWKJN-UHFFFAOYSA-N |