5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-1,3,3-trimethyl-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-1,3,3-trimethyl-1,3-dihydro-2H-indol-2-one
5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-1,3,3-trimethyl-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | G069-0430 |
| Compound Name: | 5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}-1,3,3-trimethyl-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | CC1(C)C(N(C)c2ccc(cc12)S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.588 |
| logD: | 2.4929 |
| logSw: | -3.2249 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.111 |
| InChI Key: | JXQNCPYAXWQYKW-UHFFFAOYSA-N |