N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0085 |
| Compound Name: | N-[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 394.52 |
| Molecular Formula: | C23 H30 N4 O2 |
| Smiles: | CC1NC(C2CCC(CCC=2N=1)C(NCCCN1CCCc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2027 |
| logD: | 2.1448 |
| logSw: | -2.732 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.204 |
| InChI Key: | ZHHXQYMJZSDFMF-GOSISDBHSA-N |