1-(5-{4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-1,4-diphenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethan-1-one
Chemical Structure Depiction of
1-(5-{4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-1,4-diphenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethan-1-one
1-(5-{4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-1,4-diphenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8009-6561 |
| Compound Name: | 1-(5-{4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}-1,4-diphenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl)ethan-1-one |
| Molecular Weight: | 512.01 |
| Molecular Formula: | C30 H26 Cl N3 O3 |
| Smiles: | CC(C1=NN(C(c2ccc(c(c2)OC)OCc2ccc(cc2)[Cl])N1c1ccccc1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6048 |
| logD: | 6.6048 |
| logSw: | -6.3718 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.628 |
| InChI Key: | ZNNQNQAGQUDRJF-PMERELPUSA-N |