N-(8-chloro-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)-2-methoxybenzamide
Chemical Structure Depiction of
N-(8-chloro-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)-2-methoxybenzamide
N-(8-chloro-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | 8629-0171 |
| Compound Name: | N-(8-chloro-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)-2-methoxybenzamide |
| Molecular Weight: | 385.83 |
| Molecular Formula: | C18 H12 Cl N3 O3 S |
| Smiles: | COc1ccccc1C(NC1=CN=C2N(C1=O)c1ccc(cc1S2)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6283 |
| logD: | 2.3338 |
| logSw: | -3.6911 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.706 |
| InChI Key: | JWEVTTSTHRTEAJ-UHFFFAOYSA-N |