7-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
7-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one
7-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0395 |
| Compound Name: | 7-{4-[3-(1H-indol-3-yl)propanoyl]piperazine-1-sulfonyl}-2,6-dimethyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 496.58 |
| Molecular Formula: | C25 H28 N4 O5 S |
| Smiles: | CC1C(Nc2cc(C)c(cc2O1)S(N1CCN(CC1)C(CCc1c[nH]c2ccccc12)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4207 |
| logD: | 2.42 |
| logSw: | -2.9697 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.357 |
| InChI Key: | PQGRKOXKTTYVQI-QGZVFWFLSA-N |