N-{4-[2-(2-bromoanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-cyclohexylacetamide
Chemical Structure Depiction of
N-{4-[2-(2-bromoanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-cyclohexylacetamide
N-{4-[2-(2-bromoanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-cyclohexylacetamide
Compound characteristics
Compound ID: | J056-0275 |
Compound Name: | N-{4-[2-(2-bromoanilino)-2-oxoethyl]-3-oxo-3,4-dihydroquinoxalin-2-yl}-N-cyclohexylacetamide |
Molecular Weight: | 497.39 |
Molecular Formula: | C24 H25 Br N4 O3 |
Smiles: | CC(N(C1CCCCC1)C1C(N(CC(Nc2ccccc2[Br])=O)c2ccccc2N=1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6157 |
logD: | 3.6156 |
logSw: | -3.669 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.662 |
InChI Key: | OBNOTCUMVNYLMZ-UHFFFAOYSA-N |