7-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
7-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0059 |
| Compound Name: | 7-{4-[(1H-indol-3-yl)acetyl]piperazine-1-sulfonyl}-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 468.53 |
| Molecular Formula: | C23 H24 N4 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCN(CC1)C(Cc1c[nH]c3ccccc13)=O)(=O)=O)OCC(N2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6303 |
| logD: | 1.6297 |
| logSw: | -2.6434 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.019 |
| InChI Key: | IWHOFHSLYFLONF-UHFFFAOYSA-N |