N-[(2,5-dimethylphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethylphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
N-[(2,5-dimethylphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G595-0231 |
| Compound Name: | N-[(2,5-dimethylphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C20 H21 N3 O2 S |
| Smiles: | Cc1ccc(C)c(CNC(C2=CN=C3N(C4CCCCC=4S3)C2=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1971 |
| logD: | 3.0089 |
| logSw: | -3.1583 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.037 |
| InChI Key: | QKQDHXIUZDLECS-UHFFFAOYSA-N |