[9-(4-chlorophenyl)-2-ethoxy-7,7-dimethyl-5-oxo-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinolin-4(5H)-ylidene]propanedinitrile
Chemical Structure Depiction of
[9-(4-chlorophenyl)-2-ethoxy-7,7-dimethyl-5-oxo-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinolin-4(5H)-ylidene]propanedinitrile
[9-(4-chlorophenyl)-2-ethoxy-7,7-dimethyl-5-oxo-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinolin-4(5H)-ylidene]propanedinitrile
Compound characteristics
| Compound ID: | Y020-6952 |
| Compound Name: | [9-(4-chlorophenyl)-2-ethoxy-7,7-dimethyl-5-oxo-10-sulfanylidene-9,10-dihydro-7H-pyrrolo[3,2,1-ij][1,2]thiazolo[5,4-c]quinolin-4(5H)-ylidene]propanedinitrile |
| Molecular Weight: | 505.02 |
| Molecular Formula: | C25 H17 Cl N4 O2 S2 |
| Smiles: | CCOc1cc2C(=C(C#N)C#N)C(N3c2c(c1)C1=C(C3(C)C)SN(C1=S)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2352 |
| logD: | 5.2344 |
| logSw: | -5.5111 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.863 |
| InChI Key: | IVNFUKCSFDESFZ-UHFFFAOYSA-N |