3-[2-(3-chloroanilino)-2-oxoethyl]-N,N-diethyl-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
3-[2-(3-chloroanilino)-2-oxoethyl]-N,N-diethyl-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide
3-[2-(3-chloroanilino)-2-oxoethyl]-N,N-diethyl-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
Compound ID: | J026-4472 |
Compound Name: | 3-[2-(3-chloroanilino)-2-oxoethyl]-N,N-diethyl-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide |
Molecular Weight: | 457.92 |
Molecular Formula: | C22 H24 Cl N5 O4 |
Smiles: | CCN(CC)C(c1cc(C)nc2c1C(N(CC(Nc1cccc(c1)[Cl])=O)C(N2C)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8973 |
logD: | 2.8972 |
logSw: | -3.7671 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.091 |
InChI Key: | NOMWJBYKKXFLAY-UHFFFAOYSA-N |