7-[3-(3,4-dihydroquinoline-1(2H)-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-[3-(3,4-dihydroquinoline-1(2H)-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-[3-(3,4-dihydroquinoline-1(2H)-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
Compound ID: | F184-3468 |
Compound Name: | 7-[3-(3,4-dihydroquinoline-1(2H)-carbonyl)piperidine-1-sulfonyl]-2-ethyl-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
Molecular Weight: | 497.61 |
Molecular Formula: | C26 H31 N3 O5 S |
Smiles: | CCC1C(Nc2cc(C)c(cc2O1)S(N1CCCC(C1)C(N1CCCc2ccccc12)=O)(=O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.5745 |
logD: | 3.5734 |
logSw: | -3.7789 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.999 |
InChI Key: | ZJIKBUFVWVOHEE-UHFFFAOYSA-N |