5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1,3-diphenyl-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1,3-diphenyl-1,3-diazinane-2,4,6-trione
5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1,3-diphenyl-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 2368-1284 |
Compound Name: | 5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1,3-diphenyl-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 506.52 |
Molecular Formula: | C29 H22 N4 O5 |
Smiles: | Cc1cc(C=C2C(N(C(N(C2=O)c2ccccc2)=O)c2ccccc2)=O)c(C)n1c1cccc(c1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.8301 |
logD: | 3.8301 |
logSw: | -4.0178 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 79.874 |
InChI Key: | VJNFKXAAPBRJHE-UHFFFAOYSA-N |