methyl 3-[2-(azepan-1-yl)-2-oxoethyl]-7-cyclopropyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(azepan-1-yl)-2-oxoethyl]-7-cyclopropyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 3-[2-(azepan-1-yl)-2-oxoethyl]-7-cyclopropyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | J026-2060 |
| Compound Name: | methyl 3-[2-(azepan-1-yl)-2-oxoethyl]-7-cyclopropyl-2,4-dioxo-1-phenyl-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 476.53 |
| Molecular Formula: | C26 H28 N4 O5 |
| Smiles: | COC(c1cc(C2CC2)nc2c1C(N(CC(N1CCCCCC1)=O)C(N2c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5734 |
| logD: | 3.5732 |
| logSw: | -3.7801 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.703 |
| InChI Key: | YBLFUQZVIWTDPZ-UHFFFAOYSA-N |