3-[1-(3-chloro-4-methylphenyl)-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-(3-chloro-4-methylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione
3-[1-(3-chloro-4-methylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione
Compound characteristics
| Compound ID: | C202-3379 |
| Compound Name: | 3-[1-(3-chloro-4-methylphenyl)-1H-1,2,4-triazol-5-yl]-7,7-dimethyl-1-phenyl-7,8-dihydroquinoline-2,5(1H,6H)-dione |
| Molecular Weight: | 458.95 |
| Molecular Formula: | C26 H23 Cl N4 O2 |
| Smiles: | Cc1ccc(cc1[Cl])n1c(C2=CC3=C(CC(C)(C)CC3=O)N(C2=O)c2ccccc2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.742 |
| logD: | 4.742 |
| logSw: | -4.8291 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.172 |
| InChI Key: | YHYSXFSQRDUCRU-UHFFFAOYSA-N |