N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,8-diethyl-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,8-diethyl-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,8-diethyl-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F668-0284 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,8-diethyl-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 426.43 |
| Molecular Formula: | C21 H22 N4 O6 |
| Smiles: | CCN1C2=C(C(=CC1=O)C(Nc1ccc3c(c1)OCCO3)=O)C(N(CC)C(N2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.506 |
| logD: | 0.4893 |
| logSw: | -2.0592 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.437 |
| InChI Key: | RETRZCOHYAYRKF-UHFFFAOYSA-N |