9-(4-butylphenyl)-2,7,7-trimethyl-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
Chemical Structure Depiction of
9-(4-butylphenyl)-2,7,7-trimethyl-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
9-(4-butylphenyl)-2,7,7-trimethyl-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione
Compound characteristics
| Compound ID: | 5910-0151 |
| Compound Name: | 9-(4-butylphenyl)-2,7,7-trimethyl-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinoline-4,5-dione |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C25 H24 N2 O2 S2 |
| Smiles: | CCCCc1ccc(cc1)N1C(C2=C(C(C)(C)N3C(C(c4cc(C)cc2c34)=O)=O)S1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.1712 |
| logD: | 6.1686 |
| logSw: | -5.4219 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 32.773 |
| InChI Key: | FNSRGRUFNQGTAU-UHFFFAOYSA-N |