N-[2-(azepan-1-yl)ethyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
N-[2-(azepan-1-yl)ethyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G595-0244 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C19 H26 N4 O2 S |
| Smiles: | C1CCCN(CC1)CCNC(C1=CN=C2N(C3CCCCC=3S2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.557 |
| logD: | -0.3306 |
| logSw: | -2.0317 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.192 |
| InChI Key: | FHLBZZYMMKEWBB-UHFFFAOYSA-N |