8,8-dimethyl-3-nonyl-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
8,8-dimethyl-3-nonyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
8,8-dimethyl-3-nonyl-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: | 5545-0147 |
| Compound Name: | 8,8-dimethyl-3-nonyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 413.58 |
| Molecular Formula: | C23 H31 N3 O2 S |
| Smiles: | CCCCCCCCCN1C=Nc2c3cc4COC(C)(C)Cc4nc3sc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 6.1222 |
| logD: | 6.1222 |
| logSw: | -5.2004 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.176 |
| InChI Key: | FKLQENQQNILAKI-UHFFFAOYSA-N |