methyl 3-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 3-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | J026-4019 |
| Compound Name: | methyl 3-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-7-cyclopropyl-1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-5-carboxylate |
| Molecular Weight: | 456.88 |
| Molecular Formula: | C22 H21 Cl N4 O5 |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(CN1C(c2c(cc(C3CC3)nc2N(C)C1=O)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7606 |
| logD: | 3.7604 |
| logSw: | -4.3074 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.08 |
| InChI Key: | JWVVPOZWYDYRME-UHFFFAOYSA-N |