2-[5-(azepane-1-sulfonyl)-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[5-(azepane-1-sulfonyl)-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[5-(azepane-1-sulfonyl)-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | L503-0454 |
| Compound Name: | 2-[5-(azepane-1-sulfonyl)-3,3-dimethyl-2,3-dihydro-1H-indol-1-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 419.59 |
| Molecular Formula: | C22 H33 N3 O3 S |
| Smiles: | CC1(C)CN(CC(N2CCCC2)=O)c2ccc(cc12)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6511 |
| logD: | 3.6511 |
| logSw: | -3.8636 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.901 |
| InChI Key: | IIJPJRZYEMQPTQ-UHFFFAOYSA-N |