ethyl 4-({(adamantan-1-yl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({(adamantan-1-yl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({(adamantan-1-yl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | G799-0198 |
Compound Name: | ethyl 4-({(adamantan-1-yl)-N-[(furan-2-yl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 453.58 |
Molecular Formula: | C26 H35 N3 O4 |
Smiles: | CCOC(c1c(C)c(CN(Cc2ccco2)C(NC23CC4CC(CC(C4)C3)C2)=O)c(C)[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 5.1685 |
logD: | 5.1685 |
logSw: | -5.1005 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 65.5 |
InChI Key: | WZKMHGZLYYWBGJ-UHFFFAOYSA-N |