4-{[1-(diphenylmethyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[1-(diphenylmethyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-{[1-(diphenylmethyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | V001-4616 |
| Compound Name: | 4-{[1-(diphenylmethyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 494.62 |
| Molecular Formula: | C29 H26 N4 O2 S |
| Smiles: | CC1=C(\C=C2/C(N(C(c3ccccc3)c3ccccc3)C(N2C)=S)=O)C(N(c2ccccc2)N1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9531 |
| logD: | 3.9531 |
| logSw: | -4.0404 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.785 |
| InChI Key: | ZTQJOMLUZDSDCM-UHFFFAOYSA-N |