N-cyclopropyl-2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of
N-cyclopropyl-2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide
N-cyclopropyl-2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide
Compound characteristics
| Compound ID: | V008-9682 |
| Compound Name: | N-cyclopropyl-2-[1-ethyl-4-(3-nitrophenyl)-2,5-dioxo-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]propanamide |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C20 H23 N5 O5 |
| Smiles: | CCN1C2CN(C(C)C(NC3CC3)=O)C(C=2C(c2cccc(c2)[N+]([O-])=O)NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.2719 |
| logD: | 1.0521 |
| logSw: | -2.4193 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.091 |
| InChI Key: | ZEFMECKYXXXQIO-UHFFFAOYSA-N |