ethyl 3-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 3-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
ethyl 3-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | J026-4187 |
| Compound Name: | ethyl 3-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 466.45 |
| Molecular Formula: | C23 H22 N4 O7 |
| Smiles: | CCOC(c1cc(C2CC2)nc2c1C(N(CC(Nc1ccc3c(c1)OCO3)=O)C(N2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4135 |
| logD: | 3.4134 |
| logSw: | -3.8298 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.473 |
| InChI Key: | KXMRDULZHGQLAU-UHFFFAOYSA-N |