N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)cyclobutanecarboxamide
Chemical Structure Depiction of
N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)cyclobutanecarboxamide
N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)cyclobutanecarboxamide
Compound characteristics
Compound ID: | V025-9458 |
Compound Name: | N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)cyclobutanecarboxamide |
Molecular Weight: | 403.54 |
Molecular Formula: | C21 H29 N3 O3 S |
Smiles: | CCCCN1C(C2CCCC2)=NS(c2cc(ccc12)NC(C1CCC1)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7873 |
logD: | 3.7867 |
logSw: | -3.7965 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.715 |
InChI Key: | BDKSDBDOKNGKKG-UHFFFAOYSA-N |