N-[2-(3,4-diethoxyphenyl)ethyl]-2,5-dimethyl-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2,5-dimethyl-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2,5-dimethyl-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | G895-0943 |
Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2,5-dimethyl-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide |
Molecular Weight: | 468.62 |
Molecular Formula: | C25 H32 N4 O3 S |
Smiles: | CCOc1ccc(CCNC(c2c(C)c3c(nc(C)nc3s2)N2CCCC2)=O)cc1OCC |
Stereo: | ACHIRAL |
logP: | 4.1461 |
logD: | 3.7193 |
logSw: | -4.3408 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.954 |
InChI Key: | DIQKFPPQSBLQNV-UHFFFAOYSA-N |