3-[1-(2,3-dimethylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione
Chemical Structure Depiction of
3-[1-(2,3-dimethylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione
3-[1-(2,3-dimethylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione
Compound characteristics
| Compound ID: | C202-3382 |
| Compound Name: | 3-[1-(2,3-dimethylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione |
| Molecular Weight: | 438.53 |
| Molecular Formula: | C27 H26 N4 O2 |
| Smiles: | Cc1cccc(c1C)n1c(C2=CC3=C(CC(C)(C)CC3=O)N(C2=O)c2ccccc2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.387 |
| logD: | 4.387 |
| logSw: | -4.4963 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.871 |
| InChI Key: | XBGGEQVTILREJX-UHFFFAOYSA-N |