ethyl 1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxylate
ethyl 1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxylate
Compound characteristics
Compound ID: | G242-0459 |
Compound Name: | ethyl 1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]piperidine-4-carboxylate |
Molecular Weight: | 425.55 |
Molecular Formula: | C20 H31 N3 O5 S |
Smiles: | CCOC(C1CCN(CC1)S(c1c(C(N2CCCCC2)=O)c(C)[nH]c1C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.9296 |
logD: | 1.9296 |
logSw: | -2.4455 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.139 |
InChI Key: | QCYFYGWVZKSHNX-UHFFFAOYSA-N |