2-({[(3,4-dimethoxyphenyl)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-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G769-0745 |
| Compound Name: | 2-({[(3,4-dimethoxyphenyl)methyl](2-methylpropyl)amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C24 H31 N3 O3 S |
| Smiles: | CC(C)CN(CC1=CC(N2C3CCCCC=3SC2=N1)=O)Cc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.4745 |
| logD: | 1.9639 |
| logSw: | -3.7518 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.347 |
| InChI Key: | DRURBZGGUIFEIB-UHFFFAOYSA-N |