N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]thiophene-2-carboxamide
N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | SC87-1019 |
| Compound Name: | N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C21 H21 N3 O2 S |
| Smiles: | C1CC2=C(CCC1CNC(c1cccs1)=O)N=C(c1ccccc1)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9546 |
| logD: | 2.5983 |
| logSw: | -3.4996 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.625 |
| InChI Key: | VGPQRTOZZHEGFY-AWEZNQCLSA-N |