2-(2,4-dimethylphenyl)-5-phenyl-3-sulfanylidene-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
Chemical Structure Depiction of
2-(2,4-dimethylphenyl)-5-phenyl-3-sulfanylidene-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
2-(2,4-dimethylphenyl)-5-phenyl-3-sulfanylidene-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one
Compound characteristics
| Compound ID: | Y207-5574 |
| Compound Name: | 2-(2,4-dimethylphenyl)-5-phenyl-3-sulfanylidene-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C27 H23 N3 O S |
| Smiles: | Cc1ccc(c(C)c1)N1C(C2Cc3c4ccccc4[nH]c3C(c3ccccc3)N2C1=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6381 |
| logD: | 5.6381 |
| logSw: | -5.7094 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.9323 |
| InChI Key: | NEPOQNDEHSXVGG-UHFFFAOYSA-N |