2-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G769-0316 |
| Compound Name: | 2-({[(4-fluorophenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 399.53 |
| Molecular Formula: | C22 H26 F N3 O S |
| Smiles: | CC(C)CN(CC1=CC(N2C3CCCCC=3SC2=N1)=O)Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.9306 |
| logD: | 3.6705 |
| logSw: | -3.9579 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.0866 |
| InChI Key: | OIJKDUOXCQACID-UHFFFAOYSA-N |