N-{3-[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methoxy]phenyl}-2-(phenylsulfanyl)acetamide
Chemical Structure Depiction of
N-{3-[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methoxy]phenyl}-2-(phenylsulfanyl)acetamide
N-{3-[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methoxy]phenyl}-2-(phenylsulfanyl)acetamide
Compound characteristics
| Compound ID: | C679-5963 |
| Compound Name: | N-{3-[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methoxy]phenyl}-2-(phenylsulfanyl)acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C25 H23 N3 O3 S2 |
| Smiles: | C1CCC2=C(C1)N1C(=NC(COc3cccc(c3)NC(CSc3ccccc3)=O)=CC1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 4.042 |
| logD: | 4.042 |
| logSw: | -4.1991 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.48 |
| InChI Key: | FHMYHVPBEWOBPQ-UHFFFAOYSA-N |