2,8,8-trimethyl-3-(prop-2-en-1-yl)-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
2,8,8-trimethyl-3-(prop-2-en-1-yl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2,8,8-trimethyl-3-(prop-2-en-1-yl)-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: | F081-0839 |
| Compound Name: | 2,8,8-trimethyl-3-(prop-2-en-1-yl)-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 341.43 |
| Molecular Formula: | C18 H19 N3 O2 S |
| Smiles: | CC1=Nc2c3cc4COC(C)(C)Cc4nc3sc2C(N1CC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2631 |
| logD: | 3.2631 |
| logSw: | -3.2697 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.222 |
| InChI Key: | UJMWRSJYYDFUTN-UHFFFAOYSA-N |