1-[3,3-dimethyl-5-(4-phenylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[3,3-dimethyl-5-(4-phenylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one
1-[3,3-dimethyl-5-(4-phenylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one
Compound characteristics
Compound ID: | L302-0073 |
Compound Name: | 1-[3,3-dimethyl-5-(4-phenylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]ethan-1-one |
Molecular Weight: | 413.54 |
Molecular Formula: | C22 H27 N3 O3 S |
Smiles: | CC(N1CC(C)(C)c2cc(ccc12)S(N1CCN(CC1)c1ccccc1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4469 |
logD: | 3.4469 |
logSw: | -3.9121 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.561 |
InChI Key: | TWELHBPCUNYNHM-UHFFFAOYSA-N |