2-[3,3-dimethyl-5-(4-methylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[3,3-dimethyl-5-(4-methylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[3,3-dimethyl-5-(4-methylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | L503-0505 |
| Compound Name: | 2-[3,3-dimethyl-5-(4-methylpiperazine-1-sulfonyl)-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 420.57 |
| Molecular Formula: | C21 H32 N4 O3 S |
| Smiles: | CC1(C)CN(CC(N2CCCC2)=O)c2ccc(cc12)S(N1CCN(C)CC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0595 |
| logD: | 1.9969 |
| logSw: | -3.0192 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.047 |
| InChI Key: | KGXSIAUXCYQQRN-UHFFFAOYSA-N |