8-{[(2-chlorophenyl)methyl]sulfanyl}-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Chemical Structure Depiction of
8-{[(2-chlorophenyl)methyl]sulfanyl}-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
8-{[(2-chlorophenyl)methyl]sulfanyl}-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | 8640-0668 |
| Compound Name: | 8-{[(2-chlorophenyl)methyl]sulfanyl}-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
| Molecular Weight: | 442 |
| Molecular Formula: | C22 H20 Cl N3 O S2 |
| Smiles: | Cc1c2COC(C)(C)Cc2c2c3c(c(ncn3)SCc3ccccc3[Cl])sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.2888 |
| logD: | 6.2888 |
| logSw: | -6.2504 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.309 |
| InChI Key: | LXIMPTXQKCNVGM-UHFFFAOYSA-N |