(4-chloro-3-nitrophenyl)[3-(2,4-dichlorophenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone
Chemical Structure Depiction of
(4-chloro-3-nitrophenyl)[3-(2,4-dichlorophenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone
(4-chloro-3-nitrophenyl)[3-(2,4-dichlorophenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone
Compound characteristics
| Compound ID: | C250-0718 |
| Compound Name: | (4-chloro-3-nitrophenyl)[3-(2,4-dichlorophenyl)-2-sulfanylidene-1,4-diazaspiro[4.5]dec-3-en-1-yl]methanone |
| Molecular Weight: | 496.8 |
| Molecular Formula: | C21 H16 Cl3 N3 O3 S |
| Smiles: | C1CCC2(CC1)N=C(C(N2C(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=S)c1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5615 |
| logD: | 5.5615 |
| logSw: | -6.0082 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.886 |
| InChI Key: | ZOHFBKXYQJUPGP-UHFFFAOYSA-N |