N-[(5-bromo-2-methoxyphenyl)methyl]-1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)piperidine-3-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)piperidine-3-carboxamide
Compound characteristics
Compound ID: | F602-0217 |
Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)piperidine-3-carboxamide |
Molecular Weight: | 448.36 |
Molecular Formula: | C21 H26 Br N3 O3 |
Smiles: | [H]c1c(C)c(C(N2CCCC(C2)C(NCc2cc(ccc2OC)[Br])=O)=O)[nH]c1C |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9239 |
logD: | 2.9239 |
logSw: | -3.1405 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.075 |
InChI Key: | LRHWZXMZRPRTCR-HNNXBMFYSA-N |