2-[7-benzyl-2-(4-fluorophenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[7-benzyl-2-(4-fluorophenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-[7-benzyl-2-(4-fluorophenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C201-1842 |
| Compound Name: | 2-[7-benzyl-2-(4-fluorophenyl)-4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3(4H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C30 H33 F N4 O2 |
| Smiles: | C1CCC(CCNC(CN2C(c3ccc(cc3)F)=NC3CN(CCC=3C2=O)Cc2ccccc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.7562 |
| logD: | 2.8315 |
| logSw: | -4.0202 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.3 |
| InChI Key: | AQWFGISJQZKDJN-UHFFFAOYSA-N |