3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F952-1987 |
| Compound Name: | 3-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-6-(pyrrolidine-1-sulfonyl)-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C22 H23 N3 O4 S2 |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)SC(N2CCC(N1CCc2ccccc12)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7451 |
| logD: | 3.7451 |
| logSw: | -3.9939 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.29 |
| InChI Key: | OPKSZQJKXROCJG-UHFFFAOYSA-N |