2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-cyclopentylacetamide
Chemical Structure Depiction of
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-cyclopentylacetamide
2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-cyclopentylacetamide
Compound characteristics
Compound ID: | C989-0293 |
Compound Name: | 2-[6-(azepane-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]-N-cyclopentylacetamide |
Molecular Weight: | 421.51 |
Molecular Formula: | C20 H27 N3 O5 S |
Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)OC(N2CC(NC1CCCC1)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6698 |
logD: | 2.6698 |
logSw: | -3.3298 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.672 |
InChI Key: | AGMQCRNYHGKKES-UHFFFAOYSA-N |