N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-1011 |
| Compound Name: | N-[(1-methyl-1H-benzimidazol-2-yl)methyl]-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 427.51 |
| Molecular Formula: | C25 H25 N5 O2 |
| Smiles: | Cn1c2ccccc2nc1CNC(C1CCC2=C(CC1)N=C(c1ccccc1)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4856 |
| logD: | 2.1293 |
| logSw: | -2.8104 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.593 |
| InChI Key: | JOMIORNCSFCQMZ-QGZVFWFLSA-N |