4-methoxy-3-({[6-methyl-3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)benzaldehyde
Chemical Structure Depiction of
4-methoxy-3-({[6-methyl-3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)benzaldehyde
4-methoxy-3-({[6-methyl-3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)benzaldehyde
Compound characteristics
| Compound ID: | F143-0095 |
| Compound Name: | 4-methoxy-3-({[6-methyl-3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)benzaldehyde |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C22 H19 N3 O3 S3 |
| Smiles: | Cc1ccc(cc1)N1C2=C(C(N(C)C(=N2)SCc2cc(C=O)ccc2OC)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 4.1635 |
| logD: | 4.1635 |
| logSw: | -4.2751 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 49.393 |
| InChI Key: | UNDSZHDNDDPKPV-UHFFFAOYSA-N |