N-[(5-bromo-2-methoxyphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G595-0280 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 448.34 |
| Molecular Formula: | C19 H18 Br N3 O3 S |
| Smiles: | COc1ccc(cc1CNC(C1=CN=C2N(C3CCCCC=3S2)C1=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7751 |
| logD: | 2.7307 |
| logSw: | -3.2487 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.667 |
| InChI Key: | OVZBMEOPSXWMMD-UHFFFAOYSA-N |