1-(3,4-dichlorophenyl)-5-{[4-(2-methylpropoxy)phenyl]methylidene}-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(3,4-dichlorophenyl)-5-{[4-(2-methylpropoxy)phenyl]methylidene}-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(3,4-dichlorophenyl)-5-{[4-(2-methylpropoxy)phenyl]methylidene}-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8008-4773 |
| Compound Name: | 1-(3,4-dichlorophenyl)-5-{[4-(2-methylpropoxy)phenyl]methylidene}-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 525.45 |
| Molecular Formula: | C27 H22 Cl2 N2 O3 S |
| Smiles: | CC(C)COc1ccc(\C=C2/C(N(C(N(C2=O)c2ccc(c(c2)[Cl])[Cl])=S)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4504 |
| logD: | 6.4504 |
| logSw: | -6.2674 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 38.02 |
| InChI Key: | ACYMMAXHRSVVNF-UHFFFAOYSA-N |