4',4',6',8'-tetramethyl-1,6-diphenyl-2-sulfanylidene-2,3-dihydro-1H,2'H,4'H-spiro[pyrimidine-4,1'-pyrrolo[3,2,1-ij]quinolin]-2'-one
Chemical Structure Depiction of
4',4',6',8'-tetramethyl-1,6-diphenyl-2-sulfanylidene-2,3-dihydro-1H,2'H,4'H-spiro[pyrimidine-4,1'-pyrrolo[3,2,1-ij]quinolin]-2'-one
4',4',6',8'-tetramethyl-1,6-diphenyl-2-sulfanylidene-2,3-dihydro-1H,2'H,4'H-spiro[pyrimidine-4,1'-pyrrolo[3,2,1-ij]quinolin]-2'-one
Compound characteristics
| Compound ID: | Y021-2877 |
| Compound Name: | 4',4',6',8'-tetramethyl-1,6-diphenyl-2-sulfanylidene-2,3-dihydro-1H,2'H,4'H-spiro[pyrimidine-4,1'-pyrrolo[3,2,1-ij]quinolin]-2'-one |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C30 H27 N3 O S |
| Smiles: | CC1=CC(C)(C)N2C(C3(C=C(c4ccccc4)N(C(N3)=S)c3ccccc3)c3cc(C)cc1c23)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5314 |
| logD: | 6.5312 |
| logSw: | -5.7084 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.2854 |
| InChI Key: | XPBNWCJXTLCFBU-PMERELPUSA-N |