[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | F081-0879 |
| Compound Name: | [(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C16 H15 N3 O3 S2 |
| Smiles: | CC1(C)Cc2c(CO1)cc1c3c(c(ncn3)SCC(O)=O)sc1n2 |
| Stereo: | ACHIRAL |
| logP: | 2.7549 |
| logD: | -0.7102 |
| logSw: | -2.598 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.888 |
| InChI Key: | SMEFTQRZRAECCR-UHFFFAOYSA-N |