N-(3-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)prop-2-enamide
Chemical Structure Depiction of
N-(3-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)prop-2-enamide
N-(3-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)prop-2-enamide
Compound characteristics
| Compound ID: | T001-0599 |
| Compound Name: | N-(3-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)prop-2-enamide |
| Molecular Weight: | 247.29 |
| Molecular Formula: | C13 H17 N3 O2 |
| Smiles: | CN1C=NC2CCC(CCC=2C1=O)NC(C=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0468 |
| logD: | 0.0468 |
| logSw: | -0.7565 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.632 |
| InChI Key: | MHHZYXFSJKKHDH-SECBINFHSA-N |