N,N-dibenzyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
N,N-dibenzyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
N,N-dibenzyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | D358-0508 |
| Compound Name: | N,N-dibenzyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C25 H23 N3 O2 S |
| Smiles: | C1CCC2=C(C1)N1C(=NC=C(C(N(Cc3ccccc3)Cc3ccccc3)=O)C1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 3.4965 |
| logD: | 3.4965 |
| logSw: | -3.5841 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.563 |
| InChI Key: | GXUFZYALHYIXQJ-UHFFFAOYSA-N |