2-ethyl-8,8-dimethyl-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-ethyl-8,8-dimethyl-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-ethyl-8,8-dimethyl-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: | 6131-0128 |
| Compound Name: | 2-ethyl-8,8-dimethyl-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: | 355.46 |
| Molecular Formula: | C19 H21 N3 O2 S |
| Smiles: | CCC1=Nc2c3cc4COC(C)(C)Cc4nc3sc2C(N1CC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5757 |
| logD: | 3.5757 |
| logSw: | -3.7724 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.314 |
| InChI Key: | XQMGAOVMBWPFPO-UHFFFAOYSA-N |