4-amino-2-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-amino-2-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]pyrimidine-5-carboxamide
4-amino-2-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]pyrimidine-5-carboxamide
Compound characteristics
Compound ID: | M503-1373 |
Compound Name: | 4-amino-2-(azepan-1-yl)-N-[(4-ethoxyphenyl)methyl]pyrimidine-5-carboxamide |
Molecular Weight: | 369.47 |
Molecular Formula: | C20 H27 N5 O2 |
Smiles: | CCOc1ccc(CNC(c2cnc(nc2N)N2CCCCCC2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 2.9945 |
logD: | 2.9941 |
logSw: | -3.2664 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 74.275 |
InChI Key: | UZAXGGMCMSBCDH-UHFFFAOYSA-N |