2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-1158 |
| Compound Name: | 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 315.37 |
| Molecular Formula: | C17 H21 N3 O3 |
| Smiles: | CC1NC(C2CCC(CCC=2N=1)C(NCc1ccc(C)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2443 |
| logD: | 1.2424 |
| logSw: | -2.0334 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.813 |
| InChI Key: | YHTABDXNOGQGQN-GFCCVEGCSA-N |