methyl [(2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetate
methyl [(2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 8640-0695 |
| Compound Name: | methyl [(2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]acetate |
| Molecular Weight: | 451.57 |
| Molecular Formula: | C23 H21 N3 O3 S2 |
| Smiles: | CC1(C)Cc2c(CO1)c(c1ccccc1)nc1c2c2c(c(ncn2)SCC(=O)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.0293 |
| logD: | 5.0293 |
| logSw: | -5.0409 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.081 |
| InChI Key: | QMDWJFHFFVWATA-UHFFFAOYSA-N |