N-cyclopentyl-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
N-cyclopentyl-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide
Compound characteristics
Compound ID: | D473-1971 |
Compound Name: | N-cyclopentyl-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-5-(4-methoxyphenyl)-1H-pyrazole-3-carboxamide |
Molecular Weight: | 403.5 |
Molecular Formula: | C20 H25 N3 O4 S |
Smiles: | COc1ccc(cc1)c1cc(C(NC2CCCC2)=O)nn1C1CCS(C1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3229 |
logD: | 2.3229 |
logSw: | -2.9222 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.38 |
InChI Key: | VMUQRXMMRVBUEA-MRXNPFEDSA-N |