ethyl 3-[2-(3-cyanoanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 3-[2-(3-cyanoanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
ethyl 3-[2-(3-cyanoanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | J026-3984 |
| Compound Name: | ethyl 3-[2-(3-cyanoanilino)-2-oxoethyl]-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 421.41 |
| Molecular Formula: | C21 H19 N5 O5 |
| Smiles: | CCOC(c1cc(C)nc2c1C(N(CC(Nc1cccc(C#N)c1)=O)C(N2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6391 |
| logD: | 2.639 |
| logSw: | -3.0103 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.969 |
| InChI Key: | XTAPCTKLKWDCCC-UHFFFAOYSA-N |