2-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G769-1005 |
| Compound Name: | 2-{[{[4-(propan-2-yl)phenyl]methyl}(propyl)amino]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 409.59 |
| Molecular Formula: | C24 H31 N3 O S |
| Smiles: | CCCN(CC1=CC(N2C3CCCCC=3SC2=N1)=O)Cc1ccc(cc1)C(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.7861 |
| logD: | 3.8934 |
| logSw: | -4.3714 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.065 |
| InChI Key: | HTYKXECGPOHLMN-UHFFFAOYSA-N |