N-(2H-1,3-benzodioxol-5-yl)-5,7-dimethyl-4-(pyrrolidin-1-yl)pyrido[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5,7-dimethyl-4-(pyrrolidin-1-yl)pyrido[2,3-d]pyrimidine-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5,7-dimethyl-4-(pyrrolidin-1-yl)pyrido[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | P432-0384 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5,7-dimethyl-4-(pyrrolidin-1-yl)pyrido[2,3-d]pyrimidine-2-carboxamide |
Molecular Weight: | 391.43 |
Molecular Formula: | C21 H21 N5 O3 |
Smiles: | Cc1cc(C)nc2c1c(nc(C(Nc1ccc3c(c1)OCO3)=O)n2)N1CCCC1 |
Stereo: | ACHIRAL |
logP: | 4.042 |
logD: | 4.0418 |
logSw: | -4.2006 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.231 |
InChI Key: | DMHQQQVTWMAJLB-UHFFFAOYSA-N |