3-[2-(3-chloro-2-methylanilino)-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-chloro-2-methylanilino)-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-chloro-2-methylanilino)-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: | J026-4407 |
| Compound Name: | 3-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-N,N-diethyl-1,7-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 471.94 |
| Molecular Formula: | C23 H26 Cl N5 O4 |
| Smiles: | CCN(CC)C(c1cc(C)nc2c1C(N(CC(Nc1cccc(c1C)[Cl])=O)C(N2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9511 |
| logD: | 2.951 |
| logSw: | -3.7117 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.393 |
| InChI Key: | ZMBFHXBJYYJHDM-UHFFFAOYSA-N |