6-chloro-4-(2-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-(2-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-(2-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F438-0356 |
| Compound Name: | 6-chloro-4-(2-{4-[(1-methyl-1H-indol-3-yl)methyl]piperazin-1-yl}-2-oxoethyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 452.94 |
| Molecular Formula: | C24 H25 Cl N4 O3 |
| Smiles: | [H]c1ccc2c(c1)c(CN1CCN(CC1)C(CN1C(COc3ccc(cc13)[Cl])=O)=O)c([H])n2C |
| Stereo: | ACHIRAL |
| logP: | 2.2464 |
| logD: | 1.2445 |
| logSw: | -3.0217 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.561 |
| InChI Key: | MRKYCMBPLHKNBS-UHFFFAOYSA-N |