N-[3-methyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Chemical Structure Depiction of
N-[3-methyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
N-[3-methyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Compound characteristics
| Compound ID: | F269-0680 |
| Compound Name: | N-[3-methyl-1-(4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[d]pyrimidin-2-yl)-1H-pyrazol-5-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C23 H25 N5 O5 |
| Smiles: | Cc1cc(NC(/C=C/c2cc(c(c(c2)OC)OC)OC)=O)n(C2NC(C3CCCC=3N=2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6883 |
| logD: | 1.5321 |
| logSw: | -2.3415 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.938 |
| InChI Key: | XCLYLJKUPKZBTM-UHFFFAOYSA-N |