N-{4-[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{4-[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl}thiophene-2-carboxamide
N-{4-[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G756-1086 |
| Compound Name: | N-{4-[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 391.45 |
| Molecular Formula: | C21 H17 N3 O3 S |
| Smiles: | CC1C=CN2C(C=1)=NC(COc1ccc(cc1)NC(c1cccs1)=O)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.0112 |
| logD: | 3.0111 |
| logSw: | -3.4267 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.562 |
| InChI Key: | KITBXFNECCAQTB-UHFFFAOYSA-N |