1-(2,3-dichlorophenyl)-5-({1-[(naphthalen-2-yl)methyl]-1H-indol-3-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
1-(2,3-dichlorophenyl)-5-({1-[(naphthalen-2-yl)methyl]-1H-indol-3-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
1-(2,3-dichlorophenyl)-5-({1-[(naphthalen-2-yl)methyl]-1H-indol-3-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
Compound ID: | 3728-1595 |
Compound Name: | 1-(2,3-dichlorophenyl)-5-({1-[(naphthalen-2-yl)methyl]-1H-indol-3-yl}methylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione |
Molecular Weight: | 556.47 |
Molecular Formula: | C30 H19 Cl2 N3 O2 S |
Smiles: | C(c1ccc2ccccc2c1)n1cc(\C=C2/C(NC(N(C2=O)c2cccc(c2[Cl])[Cl])=S)=O)c2ccccc12 |
Stereo: | ACHIRAL |
logP: | 6.9342 |
logD: | 4.5257 |
logSw: | -6.8126 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.388 |
InChI Key: | CMUBDKNVLOHGSH-UHFFFAOYSA-N |