N-[2-(3,4-dihydroquinolin-1(2H)-yl)ethyl]-3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroquinolin-1(2H)-yl)ethyl]-3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanamide
N-[2-(3,4-dihydroquinolin-1(2H)-yl)ethyl]-3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanamide
Compound characteristics
Compound ID: | K906-4586 |
Compound Name: | N-[2-(3,4-dihydroquinolin-1(2H)-yl)ethyl]-3-(1,4-dimethyl-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-sulfonyl)propanamide |
Molecular Weight: | 484.57 |
Molecular Formula: | C24 H28 N4 O5 S |
Smiles: | CN1C(C(N(C)c2cc(ccc12)S(CCC(NCCN1CCCc2ccccc12)=O)(=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 0.6089 |
logD: | 0.6019 |
logSw: | -2.441 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.488 |
InChI Key: | ITPYFNQGWHUTCQ-UHFFFAOYSA-N |