2-[(dibenzylamino)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-[(dibenzylamino)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-[(dibenzylamino)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G769-0277 |
| Compound Name: | 2-[(dibenzylamino)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 415.56 |
| Molecular Formula: | C25 H25 N3 O S |
| Smiles: | C1CCC2=C(C1)N1C(=NC(CN(Cc3ccccc3)Cc3ccccc3)=CC1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 4.1204 |
| logD: | 4.0651 |
| logSw: | -4.2641 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.815 |
| InChI Key: | JRCQXSBELSCKMM-UHFFFAOYSA-N |