2-[4-(3-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[4-(3-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide
2-[4-(3-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | V018-3506 |
| Compound Name: | 2-[4-(3-chlorophenyl)-2,5-dioxo-1-(prop-2-en-1-yl)-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-[2-(morpholin-4-yl)ethyl]acetamide |
| Molecular Weight: | 473.96 |
| Molecular Formula: | C23 H28 Cl N5 O4 |
| Salt: | not_available |
| Smiles: | C=CCN1C2CN(CC(NCCN3CCOCC3)=O)C(C=2C(c2cccc(c2)[Cl])NC1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8357 |
| logD: | 0.7693 |
| logSw: | -2.5314 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.919 |
| InChI Key: | MJSBYYCDTVXECN-OAQYLSRUSA-N |