2-[(2,5-dimethylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-[(2,5-dimethylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-[(2,5-dimethylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | C679-3877 |
| Compound Name: | 2-[(2,5-dimethylphenoxy)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 340.44 |
| Molecular Formula: | C19 H20 N2 O2 S |
| Smiles: | Cc1ccc(C)c(c1)OCC1=CC(N2C3CCCCC=3SC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7474 |
| logD: | 3.7474 |
| logSw: | -3.9251 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.689 |
| InChI Key: | SMBUNEUEYBUOHB-UHFFFAOYSA-N |