2-[(4-chloro-2-methylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-[(4-chloro-2-methylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-[(4-chloro-2-methylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | C679-3882 |
| Compound Name: | 2-[(4-chloro-2-methylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 360.86 |
| Molecular Formula: | C18 H17 Cl N2 O2 S |
| Smiles: | Cc1cc(ccc1OCC1=CC(N2C3CCCCC=3SC2=N1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3276 |
| logD: | 4.3276 |
| logSw: | -4.5936 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.689 |
| InChI Key: | JJUBJIDAWJMLKV-UHFFFAOYSA-N |