3-[(4-fluorophenyl)methyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(4-fluorophenyl)methyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F081-0939 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 395.45 |
| Molecular Formula: | C21 H18 F N3 O2 S |
| Smiles: | CC1(C)Cc2c(CO1)cc1c3c(C(N(Cc4ccc(cc4)F)C=N3)=O)sc1n2 |
| Stereo: | ACHIRAL |
| logP: | 3.6515 |
| logD: | 3.6514 |
| logSw: | -4.0025 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.926 |
| InChI Key: | PETRPOZXJGALLV-UHFFFAOYSA-N |