N-[(5-methylfuran-2-yl)methyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-3-carboxamide
N-[(5-methylfuran-2-yl)methyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-3-carboxamide
Compound characteristics
Compound ID: | F899-0178 |
Compound Name: | N-[(5-methylfuran-2-yl)methyl]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-3-carboxamide |
Molecular Weight: | 448.54 |
Molecular Formula: | C21 H28 N4 O5 S |
Smiles: | Cc1ccc(CNC(C2CCCN(C2)S(c2cc(C(N3CCCC3)=O)[nH]c2)(=O)=O)=O)o1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.5617 |
logD: | 1.5617 |
logSw: | -2.5113 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.729 |
InChI Key: | KDMLCPRQRRBEGP-INIZCTEOSA-N |