N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methylbutanamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methylbutanamide
N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methylbutanamide
Compound characteristics
Compound ID: | F866-0006 |
Compound Name: | N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methylbutanamide |
Molecular Weight: | 324.44 |
Molecular Formula: | C16 H24 N2 O3 S |
Smiles: | CC(C)CC(NCCS(N1CCc2ccccc2C1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6211 |
logD: | 1.6211 |
logSw: | -2.4241 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.09 |
InChI Key: | ZOBIDJUVORDSIN-UHFFFAOYSA-N |